SCHEMBL25824780

SCHEMBL25824780

Brc1c(-c2ccc3ccccc3c2)oc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 5/20 0.43
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
TP53 P04637 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
ST6GAL1 P15907 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
CDK2 P24941 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL6585300 0.82 ESR1 (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL15876264 0.80 HPGD (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6825859 0.78 KMT2A (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL22960257 0.78 CHRM2 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28372455 0.76 KDM4E (0.40) ANO1HSD17B10KDM4EMEN1TP53
SCHEMBL30112705 0.76 KDM4E (0.40) ANO1HSD17B10KDM4EMEN1TP53
SCHEMBL6825720 0.76 MAPK14 (0.52) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28356532 0.76 LMNA (0.58) ANO1CHRM2CHRM4CHRM5CHRM1
SCHEMBL28356499 0.75 MEN1 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL13318264 0.75 CYP1A2 (0.46) HSD17B10KDM4EMEN1TP53KMT2A

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
WO-2023132488-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-13 WO disclosed