SCHEMBL9681934

SCHEMBL9681934

C=CCC(N)(CC=C)CCCCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
SMPD1 P17405 4/20 0.39
FDPS P14324 2/20 0.39
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.35
TNNC1 P63316 5/20 0.33
DNM1 Q05193 3/20 0.33
SGPL1 O95470 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
GPR183 P32249 1/20 0.33
CERS2 Q96G23 1/20 0.33
S1PR3 Q99500 1/20 0.33
S1PR5 Q9H228 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GGPS1 O95749 1/20 0.33

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
SCHEMBL11043945 1.00 TSHR (0.44) TSHRSMPD1FDPSALDH1A1THRB
SCHEMBL28615894 1.00 TSHR (0.44) TSHRSMPD1FDPSALDH1A1THRB
SCHEMBL9463177 1.00 TSHR (0.44) TSHRSMPD1FDPSALDH1A1THRB
Hydrochloric Acid SCHEMBL11722444 0.98 TSHR (0.43) TSHRSMPD1FDPSALDH1A1THRB
Bromide SCHEMBL29216856 0.98 TSHR (0.43) TSHRSMPD1FDPSALDH1A1THRB
Hydrochloric Acid SCHEMBL11578293 0.98 TSHR (0.43) TSHRSMPD1FDPSALDH1A1THRB
SCHEMBL3237803 0.98 TSHR (0.41) TSHRSMPD1FDPSALDH1A1THRB
SCHEMBL9245821 0.91 TSHR (0.40) TSHRFDPSALDH1A1
SCHEMBL9701841 0.90 SMPD1 (0.40) TSHRSMPD1FDPSALDH1A1TNNC1
Bromide SCHEMBL9850859 0.89 TSHR (0.39) TSHRFDPSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114216354-B Insulating heat pipe with compact anti-seepage fluororesin coating 北京高科宏烽电力技术有限公司 2022-05-13 CN claimed
CN-114216354-A Insulating heat pipe with compact anti-seepage fluororesin coating 北京高科宏烽电力技术有限公司 2022-03-22 CN claimed
CN-1142135-C Prepn of hydrophobic monomer 清华大学 2004-03-17 CN claimed
CN-1129618-C Process for preparing hydrophobic viscosity increaser of water-soluble polymer UNIV TSINGHUA (CN) 2003-12-03 CN claimed
CN-1344708-A Prepn of hydrophobic monomer UNIV QINGHUA (CN) 2002-04-17 CN claimed
CN-1342721-A Process for preparing hydrophobic viscosity increaser of water-soluble polymer UNIV QINGHUA (CN) 2002-04-03 CN claimed
CN-114216354-B Insulating heat pipe with compact anti-seepage fluororesin coating 北京高科宏烽电力技术有限公司 2022-05-13 CN disclosed
CN-114216354-A Insulating heat pipe with compact anti-seepage fluororesin coating 北京高科宏烽电力技术有限公司 2022-03-22 CN disclosed
CN-1142135-C Prepn of hydrophobic monomer 清华大学 2004-03-17 CN disclosed
CN-1129618-C Process for preparing hydrophobic viscosity increaser of water-soluble polymer UNIV TSINGHUA (CN) 2003-12-03 CN disclosed
CN-1344708-A Prepn of hydrophobic monomer UNIV QINGHUA (CN) 2002-04-17 CN disclosed
CN-1342721-A Process for preparing hydrophobic viscosity increaser of water-soluble polymer UNIV QINGHUA (CN) 2002-04-03 CN disclosed
US-5101047-A Sulfobetaine-substituted α-sulfonylcarboxylic acids from diallylammonium salts and a process for the preparation thereof BALLSCHUH DETLEF (DE) 1992-03-31 US disclosed
US-5101046-A 3-CHLOROMETHYLSULFONYLMETHYL-4-SULFOMETHYL-PYRROLIDINIUM-BETAINES AND PROCESS FOR THEIR PREPARATION BALLSCHUH DETLEF (DE) 1992-03-31 US disclosed
EP-0055048-B1 POLYMERS, PREPARATION AND USE Smith and Nephew Associated Companies p.l.c. (GB) 1985-04-03 EP disclosed
US-4451624-A Polymers, preparation and use SMITH AND NEPHEW ASSOCIATED COMPANIES LTD. (GB) 1984-05-29 US disclosed
EP-0055048-A2 Polymers, preparation and use Smith and Nephew Associated Companies p.l.c. (GB) 1982-06-30 EP disclosed