SCHEMBL4894020

SCHEMBL4894020

CCCCC(S)C(C)(C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.35
CA2 P00918 6/20 0.33
MAPK1 P28482 1/20 0.33
CA1 P00915 3/20 0.32
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP3A4 P08684 1/20 0.30
FDPS P14324 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
SCHEMBL3441170 0.79 OPRM1 (0.34) DNM1CA2FDPS
SCHEMBL11776581 0.75 DNM1 (0.35) DNM1CA2MAPK1CA1ALDH1A1
SCHEMBL14743096 0.74 DNM1 (0.38) DNM1CA2MAPK1CA1ALDH1A1
SCHEMBL27694469 0.72 DNM1 (0.36) DNM1CA2MAPK1CA1ALDH1A1
SCHEMBL14742796 0.71 CA2 (0.35) DNM1CA2MAPK1CA1ALDH1A1
SCHEMBL6511995 0.70 LMNA (0.41) DNM1CA2TSHRFDPS
SCHEMBL5611751 0.70 CA2 (0.38) DNM1CA2MAPK1CA1ALDH1A1
SCHEMBL19114984 0.70 LMNA (0.41) DNM1CA2TSHRFDPS
SCHEMBL4239327 0.70 FDPS (0.36) DNM1CA2MAPK1CA1ALDH1A1
SCHEMBL8474287 0.68 LMNA (0.39) DNM1CA2TSHRFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293889-A1 NITRILE RUBBERS LANXESS DEUTSCHLAND GMBH (DE) 2008-11-27 US claimed
CN-117916915-A Binder composition for electrochemical element positive electrode, conductive material dispersion liquid for electrochemical element positive electrode, slurry composition for electrochemical element positive electrode, positive electrode for electrochemical element, and electrochemical element 日本瑞翁株式会社 2024-04-19 CN disclosed
CN-117480639-A Binder composition for electrochemical element, conductive material dispersion for electrochemical element, slurry for electrochemical element electrode, electrode for electrochemical element, and electrochemical element 日本瑞翁株式会社 2024-01-30 CN disclosed
CN-117355964-A Binder composition for electrochemical element, conductive material dispersion for electrochemical element, slurry for electrochemical element electrode, electrode for electrochemical element, and electrochemical element 日本瑞翁株式会社 2024-01-05 CN disclosed
CN-116472296-A Binder composition for positive electrode of nonaqueous secondary battery, conductive material dispersion for positive electrode of nonaqueous secondary battery, slurry composition for positive electrode of nonaqueous secondary battery, positive electrode for nonaqueous secondary battery, and nonaqueous secondary battery 日本瑞翁株式会社 2023-07-21 CN disclosed