SCHEMBL9718823

SCHEMBL9718823

C=CCCCCC(CCC)CCC

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.54
ALDH1A1 P00352 4/20 0.52
MAPT P10636 2/20 0.35
USP2 O75604 2/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 2/20 0.34
ABCC4 O15439 1/20 0.32
TRPA1 O75762 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
SCHEMBL25182470 0.98 TSHR (0.58) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25172412 0.98 TSHR (0.58) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25182455 0.98 TSHR (0.58) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25172371 0.96 TSHR (0.62) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25178030 0.96 TSHR (0.56) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25178897 0.94 TSHR (0.67) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25178895 0.94 TSHR (0.67) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL9718834 0.94 TSHR (0.67) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25172413 0.94 TSHR (0.60) TSHRALDH1A1MAPTUSP2CYP3A4
SCHEMBL25182423 0.94 TSHR (0.60) TSHRALDH1A1MAPTUSP2CYP3A4

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-118201905-A Cationic lipid 武田药品工业株式会社 2024-06-14 CN disclosed
WO-2023085299-A1 CATIONIC LIPID 武田薬品工業株式会社 2023-05-19 WO disclosed
US-5087793-A Isomerizing alpha-olefins over mordenite catalyst MITSUBISHI KASEI CORPORATION (JP) 1992-02-11 US disclosed
EP-0396763-A1 PROCESS FOR PRODUCING INTERNAL OLEFIN MITSUBISHI KASEI POLYTEC COMPANY (JP) 1990-11-14 EP disclosed