SCHEMBL4192274

SCHEMBL4192274

N#CCC1C=CN=C(NCCc2ccccc2Oc2ccccc2)N1c1nc2ccccc2s1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
HRH1 P35367 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6017539 0.95 NPC1 (0.34) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4191147 0.88 RAB9A (0.39) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7704487 0.86 LTA4H (0.36)
SCHEMBL4185618 0.85 KMT2A (0.42) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4192472 0.85 NPC1 (0.46) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4192264 0.82 LMNA (0.40) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4186370 0.82 RAB9A (0.42) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4192273 0.81 MAPK9 (0.39) NPC1RAB9AMAPTHTT
SCHEMBL4187924 0.81 RAB9A (0.36) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4190204 0.81 MAPT (0.37) NPC1RAB9AMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1850846-A1 COMPOSITION COMPRISING A JNK INHIBITOR AND CYCLOSPORIN Laboratoires Serono SA (CH) 2007-11-07 EP claimed
JP-2007505083-A 2007-03-08 JP claimed
EP-1696909-A1 BENZOTHIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES Applied Research Systems ARS Holding N.V. (AN) 2006-09-06 EP claimed
WO-2005097116-A1 COMPOSITION COMPRISING A JNK INHIBITOR AND CYCLOSPORIN APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-10-20 WO claimed
WO-2005025567-A1 BENZOTHIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-03-24 WO claimed
EP-2026802-A2 JNK INHIBITORS FOR TREATMENT OF SKIN DISEASES Laboratoires Serono SA (CH) 2009-02-25 EP disclosed
EP-1904181-A2 JNK INHIBITORS FOR THE TREATMENT OF ENDOMETREOSIS LABORATOIRES SERONO S.A. (CH) 2008-04-02 EP disclosed
WO-2007141224-A2 JNK INHIBITORS FOR TREATMENT OF SKIN DISEASES LABORATOIRES SERONO SA (CH) 2007-12-13 WO disclosed
WO-2007011762-A2 JNK INHIBITORS FOR THE TREATMENT OF ENDOMETREOSIS LABORATOIRES SERONO S.A. (CH) 2007-01-25 WO disclosed