SCHEMBL6219785

SCHEMBL6219785

O=Cc1cccc(OCCNC(=O)c2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.69
NPC1 O15118 6/20 0.69
SMN1; SMN2 Q16637 4/20 0.69
HPGD P15428 1/20 0.69
F10 P00742 2/20 0.65
POLB P06746 2/20 0.57
CASP3 P42574 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
RECQL P46063 1/20 0.55
MAOB P27338 2/20 0.52
MAOA P21397 1/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
BRD4 O60885 1/20 0.52
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL10495021 0.83 NPC1 (0.77) RAB9ANPC1SMN1; SMN2HPGDF10
SCHEMBL1578277 0.83 NPC1 (1.00) RAB9ANPC1SMN1; SMN2HPGDF10
SCHEMBL5014995 0.82 MAOA (0.52) RAB9ANPC1SMN1; SMN2POLBRECQL
SCHEMBL528393 0.82 MTNR1A (0.68) POLBMAOBMAOALMNAALDH1A1
SCHEMBL4522403 0.81 NPC1 (0.72) RAB9ANPC1SMN1; SMN2HPGDF10
SCHEMBL11424416 0.80 NPC1 (0.93) RAB9ANPC1SMN1; SMN2HPGDF10
SCHEMBL11433155 0.80 NPC1 (0.93) RAB9ANPC1SMN1; SMN2HPGDF10
SCHEMBL527471 0.78 MAOA (0.55) RAB9ANPC1SMN1; SMN2HPGDMAOB
SCHEMBL9059700 0.78 MAOA (0.70) RAB9ANPC1SMN1; SMN2POLBMAOB
SCHEMBL2276760 0.78 HPGD (0.56) SMN1; SMN2HPGDKMT2AMEN1LMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1171443-B1 BICYCLIC HETEROAROMATIC COMPOUNDS USEFUL AS LH AGONISTS AKZO NOBEL NV (NL) 2005-07-13 EP disclosed
US-6841553-B2 Bicyclic heteroaromatic compounds useful as LH agonists AKZO NOBEL N.V. (NL) 2005-01-11 US disclosed
US-20030212081-A1 Bicyclic heteroaromatic compounds useful as LH agonists MERCK SHARP & DOHME B.V. (NL) 2003-11-13 US disclosed
US-6569863-B1 Luteinizing hormone (LH) agonists for controlling fertility AKZO NOBEL NV (NL) 2003-05-27 US disclosed
EP-1171443-A1 BICYCLIC HETEROAROMATIC COMPOUNDS USEFUL AS LH AGONISTS Akzo Nobel N.V. (NL) 2002-01-16 EP disclosed
WO-2000061586-A1 BICYCLIC HETEROAROMATIC COMPOUNDS USEFUL AS LH AGONISTS AKZO NOBEL N.V. (NL) 2000-10-19 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 (1 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-20030212081-A1 Bicyclic heteroaromatic compounds useful as LH agonists LHCGR, GNRHR, FSHR RAB9A 3848/4885NPC1 1152/4885SMN1; SMN2 4821/4885

“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.