SCHEMBL4075472

SCHEMBL4075472

C=Cc1ccc(-c2cccc(-c3ccccc3)c2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.34
KMO O15229 1/20 0.34
PTGER1 P34995 1/20 0.34
PTGER4 P35408 1/20 0.34
PTGER3 P43115 1/20 0.34
PTGER2 P43116 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
XBP1 P17861 1/20 0.33
PTBP1 P26599 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
GALK1 P51570 1/20 0.33
BLM P54132 1/20 0.33
SMAD3 P84022 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
SCHEMBL4069489 0.87 ALDH1A1 (0.36) LMNAMAPTHTTALDH1A1BACE1
SCHEMBL4066882 0.79 FLT3 (0.34) MEN1KMT2AAPAF1NPC1LMNA
SCHEMBL8759090 0.78 PTGER1 (0.41) MAOAKMOPTGER1PTGER4PTGER3
SCHEMBL4067689 0.76 ALDH1A1 (0.40) LMNAMAPTHTTALDH1A1BACE1
SCHEMBL27675760 0.75 ALDH1A1 (0.46) MAOAMEN1KMT2ANPC1LMNA
SCHEMBL9613858 0.74 ALDH1A1 (0.39) LMNAMAPTHTTALDH1A1HPGD
Ammonia Solution, Strong SCHEMBL27824730 0.74 ALDH1A1 (0.39) LMNAMAPTHTTALDH1A1HPGD
SCHEMBL27763811 0.74 BACE1 (0.37) LMNAMAPTHTTSMN1; SMN2ALDH1A1
SCHEMBL30525464 0.74 PTGER1 (0.38) MAOAKMOPTGER1PTGER4PTGER3
SCHEMBL28992715 0.73 ALDH1A1 (0.33) LMNAMAPTHTTALDH1A1BACE1

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-2019120-B1 BLOCK COPOLYMERS NIPPON SODA CO (JP) 2016-04-13 EP disclosed
US-8193285-B2 Block copolymers NIPPON SODA CO., LTD. (JP) 2012-06-05 US disclosed
US-20090253867-A1 BLOCK COPOLYMERS NIPPON SODA CO., LTD. (JP) 2009-10-08 US disclosed
EP-2019120-A1 BLOCK COPOLYMERS Nippon Soda Co., Ltd. (JP) 2009-01-28 EP disclosed