SCHEMBL19787932

SCHEMBL19787932

c1ccc(-c2ccc3c(c2)[nH]c2ccc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.40
CCND1 P24385 2/20 0.40
FEN1 P39748 1/20 0.39
AHR P35869 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
TSPO P30536 1/20 0.37
KIF11 P52732 3/20 0.35
NPY5R Q15761 1/20 0.35
JAK2 O60674 2/20 0.35
HDAC4 P56524 1/20 0.34
GABRA1 P14867 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRA6 Q16445 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
SCHEMBL22514308 0.96 AHR (0.42) CDK4CCND1FEN1AHRKDM4E
SCHEMBL22894026 0.95 KDM4E (0.41) CDK4CCND1AHRKDM4EATM
SCHEMBL12076840 0.95 KDM4E (0.43) CDK4CCND1AHRKDM4EATM
SCHEMBL24667952 0.95 KDM4E (0.43) CDK4CCND1AHRKDM4EATM
SCHEMBL18058370 0.95 KDM4E (0.43) CDK4CCND1AHRKDM4EATM
SCHEMBL15589128 0.94 KDM4E (0.47) CDK4CCND1FEN1AHRKDM4E
SCHEMBL24443205 0.93 AHR (0.42) CDK4CCND1FEN1AHRKDM4E
SCHEMBL19787991 0.92 KDM4E (0.39) CDK4CCND1FEN1AHRKDM4E
SCHEMBL32680572 0.92 AHR (0.41) CDK4CCND1FEN1AHRKDM4E
SCHEMBL11998323 0.92 L3MBTL1 (0.49) CDK4CCND1KDM4EATML3MBTL1

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-9876173-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-01-23 US disclosed