SCHEMBL6960150

SCHEMBL6960150

CCCc1cc(NC(=O)Sc2ccccc2)c(OC)nc1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 2/20 0.34
GRM1 Q13255 1/20 0.34
IDO1 P14902 1/20 0.33
TP53 P04637 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
PDE10A Q9Y233 3/20 0.33
KDM4E B2RXH2 2/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL6956640 0.85 L3MBTL1 (0.39) MAPTSMN1; SMN2L3MBTL1ALDH1A1TP53
SCHEMBL6962159 0.83 L3MBTL1 (0.40) MAPTSMN1; SMN2L3MBTL1ALDH1A1TP53
SCHEMBL8594445 0.83 GRM1 (0.37) MAPTSMN1; SMN2ALDH1A1GRM1GAA
SCHEMBL6966654 0.81 ALDH1A1 (0.43) MAPTSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL6956204 0.81 SMN1; SMN2 (0.44) MAPTSMN1; SMN2ALDH1A1TP53NPC1
SCHEMBL6960156 0.76 ALDH1A1 (0.32) MAPTSMN1; SMN2ALDH1A1RAB9AGAA
SCHEMBL6956521 0.76 MAPT (0.42) MAPTSMN1; SMN2L3MBTL1ALDH1A1TP53
SCHEMBL6561300 0.74 GAA (0.39) MAPTSMN1; SMN2L3MBTL1ALDH1A1GAA
SCHEMBL6953240 0.72 KMT2A (0.46) MAPTSMN1; SMN2ALDH1A1IDO1NPC1
SCHEMBL8088990 0.72 MAPT (0.39) MAPTSMN1; SMN2ALDH1A1TP53NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0850222-B1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARM CO LTD (KR) 2003-05-28 EP disclosed
US-6028195-A AN ANTITUMOR AGENT WITH VERY LOW TOXICITIES SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-02-22 US disclosed
EP-0850222-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 1998-07-01 EP disclosed
WO-1998000402-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 1998-01-08 WO disclosed