SCHEMBL662014

SCHEMBL662014

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 3/20 0.47
▸ SLC22A2 O15244 2/20 0.47
▸ SLC22A1 O15245 2/20 0.47
▸ SLC22A3 O75751 2/20 0.47
▸ NOS1 P29475 2/20 0.46
▸ FLT1 P17948 1/20 0.43
▸ FLT4 P35916 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ HTR3E A5X5Y0 2/20 0.43
▸ HTR3B O95264 2/20 0.43
▸ HTR3A P46098 2/20 0.43
▸ HTR3D Q70Z44 2/20 0.43
▸ HTR3C Q8WXA8 2/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ RAB9A P51151 5/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ HPGD P15428 3/20 0.42
▸ CASP3 P42574 1/20 0.42

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
SCHEMBL4215248 0.90 HTR3E (0.53) PLAUSLC22A2SLC22A1SLC22A3NOS1
SCHEMBL1753035 0.82 FLT1 (0.44) PLAUSLC22A2SLC22A1SLC22A3NOS1
SCHEMBL2115124 0.82 FLT1 (0.44) PLAUSLC22A2SLC22A1SLC22A3NOS1
SCHEMBL4516878 0.80 HTR3E (0.51) PLAUSLC22A2SLC22A1SLC22A3NOS1
SCHEMBL4517019 0.80 RAB9A (0.55) NOS1FLT1FLT4KDRHTR3E
SCHEMBL101867 0.73 USP2 (0.65) RAB9ANPC1HPGDCASP3SENP7
SCHEMBL29478736 0.73 USP2 (0.65) RAB9ANPC1HPGDCASP3SENP7
SCHEMBL101868 0.73 USP2 (0.65) RAB9ANPC1HPGDCASP3SENP7
SCHEMBL11771956 0.71 CYP2D6 (0.56) PLAUSLC22A2SLC22A1SLC22A3NOS1
SCHEMBL7868755 0.69 KMT2A (0.50) FLT1FLT4KDRRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234928-A1 Novel Compounds for Treating Fibrosis and Inflammatory Conditions MAKSCIENTIFIC, LLC 2023-07-27 — — US disclosed
WO-2022026478-A1 NOVEL COMPOUNDS FOR TREATING FIBROSIS AND INFLAMMATORY CONDITIONS MAKSCIENTIFIC, LLC (US) 2022-02-03 — — WO disclosed
US-8853205-B2 Heteropyrrole analogs acting on cannabinoid receptors UNIVERSITY OF CONNECTICUT (US) 2014-10-07 — — US disclosed
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
US-20120046280-A1 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINOID RECEPTORS UNIVERSITY OF CONNECTICUT 2012-02-23 — — US disclosed
EP-2398323-A1 NOVEL HETERO PYRROLE ANALOGS ACTING ON CANNAPINOID RECEPTORS University of Connecticut (US) 2011-12-28 — — EP disclosed
US-8084451-B2 Heteropyrrole analogs acting on cannabinoid receptors UNIVERSITY OF CONNECTICUT (US) 2011-12-27 — — US disclosed
EP-2368881-A1 Heteropyrazole analogs acting on cannabinoid receptors University of Connecticut (US) 2011-09-28 — — EP disclosed
WO-2010104488-A1 NOVEL HETERO PYRROLE ANALOGS ACTING ON CANNAPINOID RECEPTORS UNIVERSITY OF CONNECTICUT (US) 2010-09-16 — — WO disclosed
US-20100063050-A1 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINOID RECEPTORS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2010-03-11 — — US 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
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-1845972-A2 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINIOD RECEPTORS University of Connecticut (US) 2007-10-24 — — EP disclosed
US-7109216-B2 1H-imidazole derivatives having CB1 agonistic, CB1 partial agonistic or CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. (NL) 2006-09-19 — — US disclosed
WO-2006074445-A2 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINIOD RECEPTORS MAKRIYANNIS ALEXANDROS (US) 2006-07-13 — — WO 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
CN-1556703-A With CB1Agonistic activity, CB1Partial agonist Activity or CB11H-imidazole derivatives with antagonistic activity ������ҩ�����޹�˾ 2004-12-22 — — CN 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
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 (6 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 PLAU 4676/4885SLC22A2 3718/4885SLC22A1 3335/4885
US-20120046280-A1 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINOID RECEPTORS CNR1, CNR2, CBR3 PLAU 4331/4885SLC22A2 4668/4885SLC22A1 4666/4885
US-20100063050-A1 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINOID RECEPTORS CNR2, CNR1, GPR18 PLAU 4383/4885SLC22A2 4594/4885SLC22A1 4668/4885
US-20040235854-A1 1H-imidazole derivatives having cb1 agonistic, cb1 partial agonistic or cb1 antagonistic activity CNR1, CNR2, CHRM1 PLAU 4228/4885SLC22A2 4518/4885SLC22A1 4252/4885
US-20050054679-A1 1 H-imidazole derivatives having CB1 agonistic, CB1 partial agonistic or CB1-antagonistic activity CNR1, CNR2, HRH4 PLAU 4260/4885SLC22A2 4374/4885SLC22A1 4188/4885
US-20230234928-A1 Novel Compounds for Treating Fibrosis and Inflammatory Conditions CNR2, CNR1, GPR174 PLAU 2954/4885SLC22A2 4450/4885SLC22A1 4393/4885

“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.

Send feedback