SCHEMBL9712588

SCHEMBL9712588

CCc1ccc([C]=O)c(C(=O)c2ccccc2Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.43
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
TP53 P04637 2/20 0.40
MAPT P10636 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
KMT2A Q03164 2/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39

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
SCHEMBL6143249 0.80 CES2 (0.52) RECQLLMNAHPGDCES2CES1
SCHEMBL9712400 0.79 MAPT (0.54) RECQLLMNAHPGDTP53MAPT
SCHEMBL9712447 0.79 RECQL (0.45) RECQLTP53MAPTCES2CES1
SCHEMBL9712431 0.77 RECQL (0.43) RECQLLMNAHPGDCES2CES1
SCHEMBL9712508 0.72 GAA (0.49) LMNAMAPTKMT2AGABRPGABRD
SCHEMBL50416 0.72 CES2 (0.71) RECQLLMNAHPGDCES2CES1
SCHEMBL29399311 0.72 CES2 (0.71) RECQLLMNAHPGDCES2CES1
SCHEMBL6535090 0.70 CES2 (0.44) RECQLLMNAHPGDTP53MAPT
SCHEMBL9712409 0.70 CES2 (0.44) RECQLLMNAHPGDCES2CES1
SCHEMBL1312683 0.70 CES2 (0.44) RECQLLMNAHPGDCES2CES1

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-5117057-A Insecticidal N' substituted-N-N'-disubstituted-hydrazines ROHM AND HAAS COMPANY (US) 1992-05-26 US disclosed