SCHEMBL22308145

SCHEMBL22308145

Cc1ccc2c(oc3c4ccccc4ccc23)c1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
CYP1A2 P05177 3/20 0.59
CYP2A6 P11509 2/20 0.59
KMT2A Q03164 2/20 0.56
KDM4E B2RXH2 5/20 0.53
HPGD P15428 5/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
ALDH1A1 P00352 5/20 0.46
MAPT P10636 4/20 0.46
MEN1 O00255 1/20 0.46
HSD17B10 Q99714 3/20 0.44
CYP3A4 P08684 2/20 0.44
MAPK1 P28482 2/20 0.44
CASP1 P29466 1/20 0.44
RAB9A P51151 1/20 0.44
CASP7 P55210 1/20 0.44
ATM Q13315 1/20 0.44
HIF1A Q16665 1/20 0.44
GLA P06280 1/20 0.42
STING1 Q86WV6 1/20 0.42

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
SCHEMBL5470220 0.84 HPRT1 (0.57) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL30154375 0.84 HPRT1 (0.57) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL10109870 0.83 KMT2A (0.57) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL11976504 0.82 MCL1 (0.55) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL10109860 0.81 KMT2A (0.65) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL23561582 0.80 KMT2A (0.50) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL26194008 0.80 KDM4E (0.48) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL25547596 0.79 CYP1A2 (0.47) TSHRCYP1A2CYP2A6KMT2AKDM4E
SCHEMBL862256 0.79 GLA (0.49) TSHRCYP1A2CYP2A6KMT2AALDH1A1
SCHEMBL22292733 0.78 CYP1A2 (0.50) TSHRCYP1A2CYP2A6KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200251664-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2020-08-06 US disclosed