SCHEMBL5827293

SCHEMBL5827293

Nc1cccc(CCc2c[nH]cn2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.53
MAOA P21397 2/20 0.53
CYP19A1 P11511 1/20 0.51
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PARP1 P09874 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
SIGMAR1 Q99720 2/20 0.39
BACE1 P56817 3/20 0.37
HSP90AB1 P08238 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36

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
SCHEMBL223834 0.81 BACE1 (0.50) BACE1
SCHEMBL224676 0.81 TAAR1 (0.47)
SCHEMBL222600 0.81 TAAR1 (0.47) CYP19A1LMNANOS1NOS2
SCHEMBL3151668 0.80 GFER (0.52) MAOBMAOACYP19A1MAPTHTT
SCHEMBL1753940 0.79 KCNH2 (0.50) MAOBMAOALMNARAB9ANOS1
SCHEMBL6965513 0.78 PRSS1 (0.50)
SCHEMBL224560 0.77 TAAR1 (0.51) SIGMAR1BACE1
SCHEMBL9878817 0.77 HRH3 (0.46) CYP19A1NOS1CYP11B1CYP11B2
SCHEMBL15329921 0.77 MAOA (0.40) MAOBMAOARAB9ASMN1; SMN2NOS1
SCHEMBL223971 0.77 TAAR1 (0.51) MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7026357-B2 Diphenylurea compounds LES LABORATOIRES SERVIER (FR) 2006-04-11 US disclosed
EP-1170288-B9 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists SERVIER LAB (FR) 2005-01-26 EP disclosed
US-20040224993-A1 Diphenylurea compounds LAVIELLE GILBERT (FR) 2004-11-11 US disclosed
US-6784183-B2 ANTISEROTONINE AGENTS LES LABORATOIRES SERVIER (FR) 2004-08-31 US disclosed
EP-1170288-B1 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists SERVIER LAB (FR) 2004-08-11 EP disclosed
US-20020025965-A1 Antiserotonine agents ADIR ET COMPAGNIE (FR) 2002-02-28 US disclosed
EP-1170288-A2 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists LES LABORATOIRES SERVIER (FR) 2002-01-09 EP 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 (2 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-20020025965-A1 Antiserotonine agents HTR2C, HTR3C, HTR3A MAOB 555/4885MAOA 486/4885CYP19A1 413/4885
US-20040224993-A1 Diphenylurea compounds HTR2C, HTR2A, HTR1A MAOB 200/4885MAOA 246/4885CYP19A1 1717/4885

“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.