SCHEMBL24766950

SCHEMBL24766950

Bc1c(B)c(B)c2c(-c3ccc4oc5c6cc(-c7ccccc7)ccc6ccc5c4c3)c3c(B)c(B)c(B)c(B)c3c(-c3ccccc3)c2c1B

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.37
PLA2G2A P14555 3/20 0.36
PLA2G4A P47712 3/20 0.36
CYP1A1 P04798 5/20 0.36
CYP1A2 P05177 5/20 0.36
CYP1B1 Q16678 4/20 0.36
PIM1 P11309 1/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
KDM4E B2RXH2 3/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 3/20 0.34
TSHR P16473 3/20 0.34
HSD17B10 Q99714 3/20 0.34
PRKDC P78527 3/20 0.34
ALDH1A1 P00352 2/20 0.34

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
SCHEMBL24024570 0.94 CYP1A1 (0.41) PLA2G2APLA2G4ACYP1A1CYP1A2CYP1B1
SCHEMBL24766832 0.94 CYP1A1 (0.41) PLA2G2APLA2G4ACYP1A1CYP1A2CYP1B1
SCHEMBL24908343 0.93 CYP1A1 (0.39) PGRPLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL21940408 0.93 CYP1A1 (0.42) CYP1A1CYP1A2CYP1B1CSNK2A2CSNK2B
SCHEMBL25006422 0.92 CYP1A1 (0.41) PGRPLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL25036205 0.91 KDM4E (0.39) PGRPLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL24908337 0.90 KDM4E (0.36) CYP1A1CYP1A2CYP1B1CSNK2A2CSNK2B
SCHEMBL24908242 0.89 CYP1A1 (0.43) CYP1A1CYP1A2CYP1B1CSNK2A2CSNK2B
SCHEMBL24908185 0.89 CYP1A1 (0.40) PLA2G2APLA2G4ACYP1A1CYP1A2CYP1B1
SCHEMBL24908243 0.89 CYP1A1 (0.38) CYP1A1CYP1A2CYP1B1CSNK2A2CSNK2B

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-20220285625-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2022-09-08 US disclosed