SCHEMBL6174772

SCHEMBL6174772

Cc1ccc(NC(=O)Nc2cccc(CC3=NCCN3)c2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
RAB9A P51151 3/20 0.50
MAPT P10636 1/20 0.50
HTR1B P28222 2/20 0.49
EPHX2 P34913 2/20 0.48
ACHE P22303 1/20 0.46
UBE2N P61088 1/20 0.46
PAX8 Q06710 1/20 0.46
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.46
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
PARP1 P09874 1/20 0.45
NTRK1 P04629 1/20 0.45
NTRK2 Q16620 1/20 0.45
KDR P35968 1/20 0.44
KCNJ6 P48051 1/20 0.44

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
Hydrochloric Acid SCHEMBL5827942 0.99 SMN1; SMN2 (0.52) SMN1; SMN2NPC1MEN1KMT2ARAB9A
SCHEMBL6172483 0.91 SMN1; SMN2 (0.52) SMN1; SMN2NPC1MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL5827358 0.91 SMN1; SMN2 (0.52) SMN1; SMN2NPC1MEN1KMT2ARAB9A
SCHEMBL12870032 0.80 ACHE (0.76) SMN1; SMN2NPC1MEN1KMT2ARAB9A
SCHEMBL6174219 0.80 SMN1; SMN2 (0.59) SMN1; SMN2NPC1MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL5827423 0.79 SMN1; SMN2 (0.58) SMN1; SMN2NPC1MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1143175 0.79 ACHE (0.74) SMN1; SMN2NPC1MEN1KMT2ARAB9A
SCHEMBL6172196 0.77 SMN1; SMN2 (0.53) SMN1; SMN2NPC1MEN1KMT2ARAB9A
SCHEMBL6173395 0.76 SMN1; SMN2 (0.52) SMN1; SMN2NPC1MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL5827256 0.76 SMN1; SMN2 (0.52) SMN1; SMN2NPC1MEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1170288-B9 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists SERVIER LAB (FR) 2005-01-26 EP disclosed
EP-1170288-B1 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists SERVIER LAB (FR) 2004-08-11 EP disclosed
EP-1170288-A2 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists LES LABORATOIRES SERVIER (FR) 2002-01-09 EP disclosed