SCHEMBL8925670

SCHEMBL8925670

O=C(Cl)c1ccc(C(=O)c2cc(Cl)c(C(=O)Cl)c(C(=O)Cl)c2C(=O)Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.40
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 2/20 0.37
MAPT P10636 2/20 0.37
NR4A1 P22736 1/20 0.36
KMT2A Q03164 2/20 0.36
RXRA P19793 1/20 0.35
POLB P06746 2/20 0.34
MAPK1 P28482 2/20 0.33
TSHR P16473 1/20 0.33
ALOX15 P16050 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2C9 P11712 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL2009581 0.77 ALDH1A1 (0.39) SRD5A2ALDH1A1RAB9AMAPTNR4A1
SCHEMBL10708355 0.73 CYP2C8 (0.49) SRD5A2ALDH1A1MAPTNR4A1KMT2A
SCHEMBL894684 0.71 SRD5A2 (0.55) SRD5A2ALDH1A1MAPTMAPK1HTT
SCHEMBL25180502 0.70 SRD5A2 (0.50) SRD5A2RAB9AMAPTNR4A1KMT2A
SCHEMBL104060 0.69 ALDH1A1 (0.54) SRD5A2ALDH1A1RAB9AMAPTKMT2A
Hydrochloric Acid SCHEMBL25180346 0.69 SRD5A2 (0.52) SRD5A2ALDH1A1MAPTMAPK1HTT
SCHEMBL5958358 0.69 ALDH1A1 (0.43) ALDH1A1MAPTPOLBTSHRALOX15
SCHEMBL20587670 0.68 ALDH1A1 (0.59) SRD5A2ALDH1A1MAPTTSHRALOX15
SCHEMBL68148 0.68 ALDH1A1 (0.59) SRD5A2ALDH1A1MAPTTSHRALOX15
SCHEMBL8772442 0.68 MAPK1 (0.67) SRD5A2ALDH1A1MAPTNR4A1KMT2A

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-5679759-A POLYCARBONATE OR POLYESTERCARBONATE, GRAFT POLYMER, THERMOPLASTIC AROMATIC VINYL POLYMER; TOUGHNESS, IMPACT STRENGTH BAYER AG (DE) 1997-10-21 US disclosed