SCHEMBL14103296

SCHEMBL14103296

C=c1c2ccccc2c(=C)c2c(NC)cccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
MAPT P10636 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
KDM4E B2RXH2 3/20 0.38
USP2 O75604 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RECQL P46063 2/20 0.38
POLB P06746 2/20 0.38
KEAP1 Q14145 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NFE2L2 Q16236 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PABPC1 P11940 2/20 0.35
EGFR P00533 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL26004528 0.76 IDO1 (0.45) IDO1MAPTTDP1KDM4EUSP2
SCHEMBL14023489 0.72 IDO1 (0.43) IDO1MAPTKDM4EUSP2MEN1
SCHEMBL19835498 0.71 IDO1 (0.36) IDO1USP2MEN1KMT2AKEAP1
SCHEMBL22620058 0.71 IDO1 (0.48) IDO1MAPTKDM4ERECQLALDH1A1
SCHEMBL8147899 0.70 IDO1 (0.58) IDO1MAPTTDP1KDM4EUSP2
SCHEMBL26144812 0.70 ALDH1A1 (0.32) KEAP1ALDH1A1HPGDHSD17B10NFE2L2
SCHEMBL25884154 0.69 IDO1 (0.39) IDO1MAPTTDP1KDM4EUSP2
SCHEMBL16194590 0.69 HSD17B10 (0.48) IDO1MAPTTDP1KDM4EUSP2
SCHEMBL2522240 0.69 ALDH1A1 (0.41) IDO1TDP1KDM4EKEAP1ALDH1A1
SCHEMBL28299700 0.68 CYP2A6 (0.46) IDO1MAPTTDP1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10221392-B2 Generation of pancreatic endoderm from pluripotent stem cells using small molecules NOVO NORDISK A/S (DK) 2019-03-05 US disclosed
EP-1158320-B1 Dichroic light polarizers NITTO DENKO CORP (JP) 2008-08-06 EP disclosed