SCHEMBL11245593

SCHEMBL11245593

Cc1c(C(=O)c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)O)c2ccccc2n1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.52
RORC P51449 1/20 0.50
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 5/20 0.47
NPC1 O15118 4/20 0.47
SRC P12931 3/20 0.47
MAPT P10636 4/20 0.47
MEN1 O00255 3/20 0.47
KDM4E B2RXH2 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTT P42858 2/20 0.44
GAA P10253 2/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RECQL P46063 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ATM Q13315 2/20 0.44

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
SCHEMBL984736 0.85 EGFR (0.65) EGFRKMT2AALDH1A1NPC1SRC
SCHEMBL30443220 0.85 EGFR (0.65) EGFRKMT2AALDH1A1NPC1SRC
SCHEMBL9195261 0.82 ALDH1A1 (0.56) RORCKMT2AALDH1A1NPC1MAPT
SCHEMBL11243813 0.81 CNR2 (0.61)
SCHEMBL11250963 0.81 EGFR (0.56) EGFRKMT2AALDH1A1SRCMAPT
SCHEMBL10659396 0.80 CNR2 (0.48) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL11260630 0.79 CNR2 (0.64)
SCHEMBL9959370 0.77 KMT2A (0.56) EGFRKMT2AALDH1A1NPC1SRC
SCHEMBL4658577 0.77 NPC1 (0.68) EGFRKMT2AALDH1A1NPC1SRC
SCHEMBL9815397 0.76 EGFR (0.48) EGFRKMT2AALDH1A1SRCMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4351768-A CARBONLESS, DUPLICATION, INDOLE DYES STERLING DRUG INC. (US) 1982-09-28 US disclosed
US-4322352-A Indolyl phthalide compounds STERLING DRUG INC. (US) 1982-03-30 US disclosed
US-4307018-A CHROMOGENS FOR COPYING SYSTEMS STERLING DRUG INC. (US) 1981-12-22 US disclosed
US-4251446-A COLOR PRECURSORS STERLING DRUG INC. (US) 1981-02-17 US disclosed