SCHEMBL28091640

SCHEMBL28091640

CC1CCCC(C)CC(C)C1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.33
TRPA1 O75762 2/20 0.31
TRPM8 Q7Z2W7 2/20 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
SCHEMBL10306742 0.96
SCHEMBL599394 0.96
SCHEMBL599393 0.96
SCHEMBL22878856 0.96
SCHEMBL601777 0.96
SCHEMBL132918 0.96
Ammonia Solution, Strong SCHEMBL8931560 0.92
SCHEMBL28964143 0.92
Fluoride SCHEMBL28167670 0.92
Methyl Alcohol SCHEMBL295188 0.89 CYP2C9 (0.35) CYP2C9TSHRCYP2C19TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105802758-B Cleaning Agent for PCB agent after fire 江苏筑磊电子科技有限公司 2019-04-05 CN disclosed
CN-106283621-B Polyurethane fiber dry spinning no silicon oil agent composition and preparation method thereof 烟台锐泽化学品有限公司 2018-10-02 CN disclosed
CN-106283621-A Polyurethane fiber dry spinning is with without silicon oil agent composition and preparation method thereof 烟台中纺锐泽化学制品有限公司 2017-01-04 CN disclosed
CN-105802758-A Electronic circuit board cleaning agent used after fire 江苏筑磊电子科技有限公司 2016-07-27 CN disclosed