SCHEMBL19973673

SCHEMBL19973673

[CH2]/C=C/C=C/CCC/C=C/CCCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
ALDH1A1 P00352 1/20 0.54
FASN P49327 1/20 0.47
TRPV1 Q8NER1 2/20 0.47
FAAH O00519 4/20 0.46
TERT O14746 3/20 0.41
CYP1A2 P05177 2/20 0.41
MAPT P10636 2/20 0.41
CYP2C19 P33261 2/20 0.41
BLM P54132 2/20 0.41
HSD17B10 Q99714 2/20 0.41
FABP4 P15090 2/20 0.41
PTPN1 P18031 2/20 0.41
PPARG P37231 2/20 0.41
KMT2A Q03164 2/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 2/20 0.41
GMNN O75496 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL19973674 1.00 TSHR (0.54) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL236150 0.95 TSHR (0.58) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL6757206 0.95 TSHR (0.58) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL11516157 0.95 TSHR (0.58) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL236151 0.95 TSHR (0.58) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL23493108 0.93 TSHR (0.56) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL23493109 0.93 TSHR (0.56) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL233999 0.93 TSHR (0.61) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL25181839 0.93 TSHR (0.56) TSHRALDH1A1FASNTRPV1FAAH
SCHEMBL19973816 0.93 TSHR (0.56) TSHRALDH1A1FASNTRPV1FAAH

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
CN-109715605-B Process for preparing carotenoid monoesters 巴斯夫欧洲公司 2022-04-12 CN disclosed
WO-2018050793-A1 PROCESS FOR PREPARING PHOSPHONIUM SALT ESTERS AS BUILDING BLOCKS FOR CAROTENOIDES BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050794-A1 PROCESS FOR PREPARING OF CAROTENOID MONO-ESTERS BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050795-A1 PROCESS FOR PREPARING OF CAROTENOID MONO-ESTERS BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050792-A1 PROCESS FOR PREPARING ESTERS OF 12'-APOCAROTENALS AS BUILDING BLOCKS FOR CAROTENOIDS BASF SE (DE) 2018-03-22 WO disclosed