SCHEMBL11218291

SCHEMBL11218291

CCC(=O)Oc1c(Cl)ccc(C(=O)c2ccc(Cl)cc2O)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
PKM P14618 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP3A4 P08684 2/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 5/20 0.37
TDP1 Q9NUW8 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.37
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
THRB P10828 1/20 0.35
RECQL P46063 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL28895776 0.77 ESR1 (0.41) KDM4ECYP3A4ALDH1A1HSD17B10TSHR
SCHEMBL27612735 0.73 CA1 (0.54) KDM4ECYP3A4RAB9ANPC1ALDH1A1
SCHEMBL28775514 0.71 ALOX15 (0.47) KDM4EPKMRXFP1RAB9ANPC1
SCHEMBL11219690 0.70 CNR1 (0.43) KDM4ERAB9ANPC1ALDH1A1TDP1
SCHEMBL11343615 0.70 ALDH1A1 (0.50) KDM4ERXFP1RAB9ANPC1ALDH1A1
SCHEMBL6331423 0.69 HSP90AB1 (0.67) KDM4EPKMRXFP1CYP3A4RAB9A
SCHEMBL27736565 0.68 MEN1 (0.46) CYP3A4HSD17B10TSHRPOLBKMT2A
SCHEMBL28163860 0.68 KMT2A (0.40) KDM4EALDH1A1TDP1HSD17B10RECQL
SCHEMBL10937456 0.67 CES2 (0.57) KDM4ERAB9ANPC1ALDH1A1TSHR
SCHEMBL2898218 0.67 KMT2A (0.48) CYP3A4ALDH1A1RECQLKMT2ASMN1; SMN2

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-4329360-A Benzophenones and their use as fungicides GAF CORPORATION (US) 1982-05-11 US disclosed