SCHEMBL27763551

SCHEMBL27763551

CCc1ccc2cc3ccccc3cc2c1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.41
ESR2 Q92731 6/20 0.41
CYP1A2 P05177 3/20 0.40
CYP2A6 P11509 1/20 0.40
ALOX5 P09917 2/20 0.38
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 3/20 0.36
TP53 P04637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HIF1A Q16665 1/20 0.36
CYP1B1 Q16678 1/20 0.36
FABP3 P05413 1/20 0.36
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
DHFR P00374 1/20 0.36
HEXA P06865 1/20 0.36
HEXB P07686 1/20 0.36
ATM Q13315 1/20 0.36
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35

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
SCHEMBL27763603 0.98 ESR1 (0.40) ESR1ESR2CYP1A2CYP2A6ALOX5
SCHEMBL7600324 0.84 WDR5 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10TP53
SCHEMBL6058867 0.83 ESR1 (0.42) ESR1ESR2ALDH1A1HSD17B10DHFR
SCHEMBL2727987 0.83 ESR1 (0.41) ESR1ESR2CYP1A2ALOX5ALDH1A1
Phosphine SCHEMBL28241094 0.82 WDR5 (0.43) CYP1A2CYP2A6ALDH1A1HSD17B10TP53
SCHEMBL30198594 0.79 HPRT1 (0.48) CYP1A2CYP2A6ALDH1A1HSD17B10TP53
SCHEMBL16487485 0.79 ESR1 (0.38) ESR1ESR2CYP1A2ALOX5ALDH1A1
SCHEMBL27759679 0.77 MAPT (0.48) ESR1ESR2ALDH1A1TP53L3MBTL1
SCHEMBL9137780 0.77 CYP1A2 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10L3MBTL1
SCHEMBL5749581 0.75 CYP1A2 (0.42) CYP1A2CYP2A6ALDH1A1HSD17B10L3MBTL1

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
CN-101461047-B Semiconductor element, method for manufacturing the semiconductor element, electronic device and method for manufacturing the electronic device MATSUSHITA ELECTRIC INDUSTRIAL CO LTD 2011-06-15 CN disclosed
CN-101461047-A Semiconductor element, method for manufacturing the semiconductor element, electronic device and method for manufacturing the electronic device MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 2009-06-17 CN disclosed