SCHEMBL1401804

SCHEMBL1401804

C=C(C)C(=O)OC(F)(CCCCCCCC)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
CES2 O00748 4/20 0.42
LPAR1 Q92633 1/20 0.42
LPAR3 Q9UBY5 1/20 0.42
FAAH O00519 7/20 0.37
CES1 P23141 5/20 0.37
GGPS1 O95749 3/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SMPD1 P17405 1/20 0.37
FDPS P14324 4/20 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
SCHEMBL2732937 1.00 TSHR (0.49) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL5084728 1.00 TSHR (0.49) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL27462638 1.00 TSHR (0.49) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL4864973 0.93 TSHR (0.43) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL27943024 0.89 TSHR (0.45) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL751393 0.89 TSHR (0.45) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL27458125 0.86 TSHR (0.38) TSHR
SCHEMBL27993989 0.86 CES2 (0.41) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL27603982 0.85 TSHR (0.53) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL28116062 0.85 TSHR (0.53) TSHRCES2LPAR1LPAR3FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116284554-A Self-dispersing type water-proof oil-proof soil-release treatment agent for spinning 桐乡市钜成涂装科技有限公司 2023-06-23 CN disclosed
CN-108008471-B Waterproof meteorological balloon and production method thereof 中国化工株洲橡胶研究设计院有限公司 2020-08-07 CN disclosed
EP-2292676-B1 POLYURETHANE FOAM FOR FLAME-LAMINATING INOUE MTP KK (JP) 2017-04-19 EP disclosed
US-9243103-B2 Polyurethane foam for flame-laminating INOAC CORPORATION (JP) 2016-01-26 US disclosed
US-20110091689-A1 POLYURETHANE FOAM FOR FLAME-LAMINATING INOAC CORPORATION (JP) 2011-04-21 US disclosed
EP-2292676-A1 POLYURETHANE FOAM FOR FLAME-LAMINATING Inoac Corporation (JP) 2011-03-09 EP disclosed