SCHEMBL9575260

SCHEMBL9575260

C=CCc1ccc2ccccc2c1C(=O)c1c(CC=C)ccc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 3/20 0.38
GLA P06280 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
WDR5 P61964 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL487677 0.89 KDM4E (0.49) ALDH1A1MEN1KMT2ATDP1KDM4E
SCHEMBL4564431 0.87 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL9062213 0.86 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL9618295 0.77 PTPN1 (0.44) ALDH1A1MEN1KMT2ATDP1KDM4E
SCHEMBL721648 0.77 GABRA1 (0.52) GABRA1GABRB2
SCHEMBL8112329 0.77 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL253635 0.75 HSD17B10 (0.41) ALDH1A1TDP1KDM4EGLAHPGD
SCHEMBL16541037 0.75 HPRT1 (0.39) ALDH1A1MEN1KMT2ALMNATDP1
Bicarbonate SCHEMBL28922932 0.75 TDP1 (0.56) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL7110822 0.75 GPR55 (0.48)

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
JP-5310506-A None JP disclosed
JP-H05310506-A INSECT-PROOFING AGENT AND INSECT-PROOF ARTICLE USING THE SAME OSAKA KASEI KK 1993-11-22 JP disclosed