SCHEMBL10431968

SCHEMBL10431968

ClC1=C(Cl)C(Cl)C(Cl)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.39
IDO1 P14902 1/20 0.36
DNMT1 P26358 1/20 0.36
DNMT3L Q9UJW3 1/20 0.36
DNMT3A Q9Y6K1 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GPR3 P46089 1/20 0.32
HTR2A P28223 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
CYP2A6 P11509 1/20 0.30

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
SCHEMBL9128829 0.75 CYP2A6 (0.34) S100A4ALDH1A1HPGDTSHRHSD17B10
SCHEMBL7901103 0.73 IDO1 (0.36) S100A4IDO1DNMT1DNMT3LDNMT3A
SCHEMBL29407826 0.71 S100A4 (0.43) S100A4KDM4EGPR3HTR2AALDH1A1
SCHEMBL7645697 0.70 S100A4 (0.73) S100A4IDO1DNMT1DNMT3LDNMT3A
SCHEMBL27658050 0.65 S100A4 (0.41) S100A4GPR3HTR2A
SCHEMBL5343918 0.64 GPR3 (0.46) S100A4GPR3HTR2A
SCHEMBL3885169 0.64 TSHR (0.37) S100A4HTR2ATSHRCYP2A6
SCHEMBL31266545 0.64 GPR3 (0.46) S100A4GPR3HTR2A
Hydrochloric Acid SCHEMBL29281106 0.62 GPR3 (0.44) S100A4GPR3HTR2A
SCHEMBL16220600 0.61 POLB (0.42) IDO1DNMT1DNMT3LDNMT3AKDM4E

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
EP-0384411-A1 Photochromic recording medium SEIKO INSTRUMENTS INC. (JP) 1990-08-29 EP disclosed