SCHEMBL6714879

SCHEMBL6714879

O=c1oc(=O)c2c(Cl)c(Cl)c1c1c3c(Cl)c(Cl)c(c(=O)oc3=O)c21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
ALDH1A1 P00352 2/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
CTSA P10619 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
ALOX15 P16050 1/20 0.32
NFKB1 P19838 1/20 0.32
CYP2C19 P33261 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32

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
SCHEMBL10774870 0.93 ESR1 (0.32) ESR1ESR2ALDH1A1GMNNLMNA
SCHEMBL8180408 0.90 ALDH1A1 (0.33) ESR1ESR2ALDH1A1GMNNLMNA
SCHEMBL3895699 0.90 ALDH1A1 (0.33) ALDH1A1GMNNLMNATP53CYP1A2
SCHEMBL23655896 0.78
SCHEMBL29519655 0.73
SCHEMBL22000060 0.73
SCHEMBL11846290 0.73
SCHEMBL8418907 0.69 MAPT (0.40) ESR1ESR2ALDH1A1GMNNLMNA
SCHEMBL17195961 0.65 GMNN (0.31) ALDH1A1GMNNLMNATP53CYP1A2
SCHEMBL20756055 0.62 MAOA (0.37) ESR1ESR2ALDH1A1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6810181-B2 LAYER OF A FLUORINE-CONTAINING POLYIMIDE AND A LAYER OF A FLUORINE-FREE RESIN IS INTERPOSED BETWEEN THE POLYIMIDE LAYER AND THE ELECTRODE HITACHI CHEMICAL CO., LTD. (JP) 2004-10-26 US disclosed
US-20040096161-A1 Electrode structure HITACHI CHEMICAL CO., LTD. (JP) 2004-05-20 US disclosed