SCHEMBL6685341

SCHEMBL6685341

CCC(Cl)(Cl)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
KCNN4 O15554 4/20 0.44
CYP1A2 P05177 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.38
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
ALOX15 P16050 1/20 0.36

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
SCHEMBL6680627 0.80 TSHR (0.46) TSHRKCNN4CYP1A2TAAR1MAPK1
SCHEMBL23781410 0.79 TSHR (0.50) TSHRKCNN4CYP1A2TAAR1MAPK1
SCHEMBL28366627 0.79 TSHR (0.50) TSHRKCNN4CYP1A2TAAR1MAPK1
SCHEMBL825609 0.77 TSHR (0.48) TSHRKCNN4CYP1A2TAAR1MAPK1
SCHEMBL10464795 0.77 TSHR (0.48) TSHRKCNN4CYP1A2TAAR1MAPK1
SCHEMBL6681947 0.77 TSHR (0.42) TSHRKCNN4CYP1A2TAAR1
SCHEMBL27279766 0.77 TSHR (0.42) TSHRKCNN4CYP1A2TAAR1ALDH1A1
SCHEMBL1829396 0.76 TSHR (0.52) TSHRKCNN4CYP1A2TAAR1MAPK1
SCHEMBL2878723 0.76 TSHR (0.33) TSHRKCNN4ALDH1A1TP53
SCHEMBL4295864 0.75 TSHR (0.46) TSHRKCNN4CYP1A2TAAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116925498-A High-pressure-bearing branched epoxy resin plugging material and oil-based drilling fluid 西南石油大学 2023-10-24 CN claimed
US-4512989-A IMIDOESTERS OR IMIDOTHIOESTERS HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 1985-04-23 US claimed
CN-116925498-A High-pressure-bearing branched epoxy resin plugging material and oil-based drilling fluid 西南石油大学 2023-10-24 CN disclosed
CN-115551943-A Resin composition, molded article, and method for improving properties of resin composition 出光兴产株式会社 2022-12-30 CN disclosed
EP-0985649-B1 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES (JP) 2004-11-24 EP disclosed
US-6462248-B1 THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS TORAY INDUSTRIES, INC. (JP) 2002-10-08 US disclosed
EP-1053990-A2 A method of producing an aromatic ketone and an aromatic ketone composition containing it TORAY INDUSTRIES, INC. (JP) 2000-11-22 EP disclosed
EP-0985649-A2 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES, INC. (JP) 2000-03-15 EP disclosed
US-4512989-A IMIDOESTERS OR IMIDOTHIOESTERS HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 1985-04-23 US disclosed