SCHEMBL4215248

SCHEMBL4215248

NC(=Nc1ccc(Cl)cc1)c1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR3E A5X5Y0 2/20 0.53
▸ HTR3B O95264 2/20 0.53
▸ HTR3A P46098 2/20 0.53
▸ HTR3D Q70Z44 2/20 0.53
▸ HTR3C Q8WXA8 2/20 0.53
▸ PLAU P00749 2/20 0.53
▸ SLC22A2 O15244 1/20 0.53
▸ SLC22A1 O15245 1/20 0.53
▸ SLC22A3 O75751 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ RAB9A P51151 5/20 0.50
▸ NPC1 O15118 4/20 0.50
▸ HPGD P15428 3/20 0.50
▸ CASP3 P42574 1/20 0.50
▸ SENP7 Q9BQF6 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ NOS3 P29474 4/20 0.46
▸ NOS1 P29475 4/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL662014 0.90 PLAU (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL4516878 0.86 HTR3E (0.51) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL4517019 0.86 RAB9A (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL29478736 0.79 USP2 (0.65) RAB9ANPC1HPGDCASP3SENP7
SCHEMBL101868 0.79 USP2 (0.65) RAB9ANPC1HPGDCASP3SENP7
SCHEMBL101867 0.79 USP2 (0.65) RAB9ANPC1HPGDCASP3SENP7
SCHEMBL21379771 0.73 HTR3E (0.52) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL21379768 0.73 HTR3E (0.52) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL11771956 0.73 CYP2D6 (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL4100900 0.71 HTR3E (1.00) HTR3EHTR3BHTR3AHTR3DHTR3C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729101-B2 1H-imidazole derivative having CB1, agonistic, CB1 partial agonistic or CB1 antagnistic activity SOLVAY PHARMACEUTICALS, B.V. (NL) 2014-05-20 — — US disclosed
CN-101538244-A 1H-imidazole derivatives with CB1agonistic, CB1partial agonistic or CB1antagonistic activities SOLVAY PHARM BV (NL) 2009-09-23 — — CN disclosed
US-20090181949-A1 1H-IMIDAZOLE DERIVATIVE HAVING CB1, AGONISTIC, CB1 PARTIAL AGONISTIC OR CB1 ANTAGNISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. 2009-07-16 — — US disclosed
US-7495108-B2 Imidazoline derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS, B.V. 2009-02-24 — — US disclosed
EP-1438296-B1 1H-IMIDAZOLE DERIVATIVES HAVING CB1 AGONISTIC, CB1 PARTIAL AGONISTIC OR CB1- ANTAGONISTIC ACTIVITY SOLVAY PHARM BV (NL) 2008-11-26 — — EP disclosed
EP-1725536-B1 IMIDAZOLINE DERIVATIVES HAVING CB1-ANTAGONISTIC ACTIVITY SOLVAY PHARM BV (NL) 2008-10-15 — — EP disclosed
US-20070135492-A1 Imidazoline derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS, B.V,. 2007-06-14 — — US disclosed
US-7173044-B2 Imidazoline derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. (NL) 2007-02-06 — — US disclosed
EP-1725536-A2 IMIDAZOLINE DERIVATIVES HAVING CB1-ANTAGONISTIC ACTIVITY Solvay Pharmaceuticals B.V. (NL) 2006-11-29 — — EP disclosed
US-20060241152-A9 Imidazoline derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. 2006-10-26 — — US disclosed
WO-2005099705-A2 PREPARATION OF IMIDAZOLE DERIVATIVES AND METHODS OF USE BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-27 — — WO disclosed
WO-2005080345-A2 IMIDAZOLINE DERIVATIVES HAVING CB1-ANTAGONISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. (NL) 2005-09-01 — — WO disclosed
US-20050187259-A1 Imidazoline derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. 2005-08-25 — — US disclosed
US-20050054679-A1 1 H-imidazole derivatives having CB1 agonistic, CB1 partial agonistic or CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. 2005-03-10 — — US disclosed
US-20040235854-A1 1H-imidazole derivatives having cb1 agonistic, cb1 partial agonistic or cb1 antagonistic activity SOLVAY PHARMACEUTICALS B.V. (NL) 2004-11-25 — — US disclosed
EP-1438296-A2 1H-IMIDAZOLE DERIVATIVES HAVING CB1 AGONISTIC, CB1 PARTIAL AGONISTIC OR CB1- ANTAGONISTIC ACTIVITY Solvay Pharmaceuticals B.V. (NL) 2004-07-21 — — EP disclosed
EP-1432691-A1 IMIDAZOLE-4-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF FOR TREATMENT OF OBESITY Bayer Pharmaceuticals Corporation (US) 2004-06-30 — — EP disclosed
US-20040063691-A1 Preparation and use of imidazole derivatives for treatment of obesity BAYER PHARMACEUTICALS CORPORATION 2004-04-01 — — US disclosed
WO-2003040107-A1 IMIDAZOLE-4-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF FOR TREATMENT OF OBESITY BAYER PHARMACEUTICALS CORPORATION (US) 2003-05-15 — — WO disclosed
WO-2003027076-A2 1H-IMIDAZOLE DERIVATIVES HAVING CB1 AGONISTIC, CB1 PARTIAL AGONISTIC OR CB1- ANTAGONISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. (NL) 2003-04-03 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090181949-A1 1H-IMIDAZOLE DERIVATIVE HAVING CB1, AGONISTIC, CB1 PARTIAL AGONISTIC OR CB1 ANTAGNISTIC ACTIVITY CNR1, CNR2, CHRM1 HTR3E 434/4885HTR3B 290/4885HTR3A 316/4885
US-20070135492-A1 Imidazoline derivatives having CB1-antagonistic activity CNR2, CNR1, GRIN2C HTR3E 203/4885HTR3B 90/4885HTR3A 121/4885
US-20050187259-A1 Imidazoline derivatives having CB1-antagonistic activity CNR2, CNR1, GRIN2C HTR3E 206/4885HTR3B 95/4885HTR3A 116/4885
US-20040063691-A1 Preparation and use of imidazole derivatives for treatment of obesity GPR119, GIPR, PGC HTR3E 201/4885HTR3B 114/4885HTR3A 466/4885
US-20060241152-A9 Imidazoline derivatives having CB1-antagonistic activity CNR2, CNR1, GRIN2C HTR3E 206/4885HTR3B 95/4885HTR3A 116/4885
US-20040235854-A1 1H-imidazole derivatives having cb1 agonistic, cb1 partial agonistic or cb1 antagonistic activity CNR1, CNR2, CHRM1 HTR3E 277/4885HTR3B 166/4885HTR3A 194/4885
US-20050054679-A1 1 H-imidazole derivatives having CB1 agonistic, CB1 partial agonistic or CB1-antagonistic activity CNR1, CNR2, HRH4 HTR3E 177/4885HTR3B 124/4885HTR3A 157/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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