SCHEMBL7871930

SCHEMBL7871930

CCc1cc(-c2ccc(NC(C)=O)c(CC)c2)ccc1NC(C)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 1/20 0.61
RAB9A P51151 1/20 0.61
HDAC1 Q13547 2/20 0.49
KDM4E B2RXH2 2/20 0.49
APOBEC3A P31941 1/20 0.49
GFER P55789 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
HDAC3 O15379 1/20 0.47
HDAC2 Q92769 1/20 0.47
HSD17B1 P14061 3/20 0.46
HTT P42858 2/20 0.45
HSD17B2 P37059 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45
TNIK Q9UKE5 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
SCHEMBL12101718 0.90 NPC1 (0.51) NPC1POLBMAPTRAB9AHDAC1
SCHEMBL28442966 0.84 RARB (0.51) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL16386159 0.83 RAB9A (0.47) NPC1POLBMAPTRAB9AKDM4E
SCHEMBL13905148 0.83 CYP1A2 (0.50) NPC1POLBMAPTRAB9AHTT
SCHEMBL12643380 0.81 PKM (0.47) NPC1POLBMAPTRAB9AHDAC1
SCHEMBL12462603 0.81 MAPT (0.44) NPC1POLBMAPTRAB9AHDAC1
SCHEMBL2145971 0.81 ALDH1A1 (0.57) NPC1POLBMAPTRAB9AHDAC1
SCHEMBL5353233 0.81 PKM (0.55) NPC1POLBMAPTRAB9AHDAC1
SCHEMBL6689465 0.81 MAPT (0.49) NPC1POLBMAPTRAB9AHDAC1
SCHEMBL29106631 0.81 NPC1 (0.49) NPC1POLBMAPTRAB9AHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095931-A1 Benzidine derivatives and electrophotosensitive material using the same KYOCERA MITA CORPORATION (JP) 2001-05-02 EP disclosed
EP-0648737-B1 Benzidine derivatives and electrophotosensitive material using the same MITA INDUSTRIAL CO LTD (JP) 1998-07-15 EP disclosed
EP-0799818-A2 Benzidine derivatives and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1997-10-08 EP disclosed
US-5550290-A CHARGE TRANSFER COMPOUND MITA INDUSTRIAL CO. LTD. (JP) 1996-08-27 US disclosed
EP-0648737-A1 Benzidine derivatives and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1995-04-19 EP disclosed