SCHEMBL9016045

SCHEMBL9016045

ClCc1ccc(CCl)c(Cl)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
PNMT P11086 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
IDO1 P14902 1/20 0.31

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
SCHEMBL3727971 0.88 CYP3A4 (0.42) KMT2APNMTIDO1
SCHEMBL16048450 0.84 P2RX7 (0.35) KMT2A
SCHEMBL7540822 0.76 CYP2A6 (0.41) KMT2AALDH1A1TSHR
SCHEMBL31010416 0.76 MAPK3 (0.31)
SCHEMBL28935815 0.76 MAPK3 (0.31)
SCHEMBL283449 0.74 PNMT (0.65) ALDH1A1TSHRPNMTNPSR1IDO1
SCHEMBL7466628 0.73 CSNK2A1 (0.42) KMT2AALDH1A1TSHR
SCHEMBL11807445 0.72 GABRA1 (0.48)
SCHEMBL4453260 0.72 CYP2A6 (0.56) KMT2AALDH1A1TSHR
SCHEMBL10974027 0.72 NOTUM (0.32) TSHRPNMT

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-5512654-A Semiconductive copolymers for use in luminescent devices CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 1996-04-30 US disclosed