SCHEMBL19973680

SCHEMBL19973680

[CH2]C=CC=CC=CC=CC=CCCC

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.39
FASN P49327 1/20 0.30
PTPN2 P17706 1/20 0.30
PTPN1 P18031 1/20 0.30
PTPN11 Q06124 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
SCHEMBL19973805 1.00 TSHR (0.39) TSHRALDH1A1FASNPTPN2PTPN1
SCHEMBL236578 1.00 TSHR (0.39) TSHRALDH1A1FASNPTPN2PTPN1
SCHEMBL19973679 1.00 TSHR (0.39) TSHRALDH1A1FASNPTPN2PTPN1
SCHEMBL236579 1.00 TSHR (0.39) TSHRALDH1A1FASNPTPN2PTPN1
SCHEMBL19973802 1.00 TSHR (0.39) TSHRALDH1A1FASNPTPN2PTPN1
SCHEMBL233019 0.97
SCHEMBL233020 0.97
SCHEMBL28939067 0.90 TSHR (0.41) TSHRALDH1A1FASNPTPN2PTPN1
SCHEMBL19974203 0.87 ALDH1A1 (0.45) TSHRALDH1A1FASN
SCHEMBL19974199 0.87 ALDH1A1 (0.45) TSHRALDH1A1FASN

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-2018050792-A1 PROCESS FOR PREPARING ESTERS OF 12'-APOCAROTENALS AS BUILDING BLOCKS FOR CAROTENOIDS 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-2018050794-A1 PROCESS FOR PREPARING OF CAROTENOID MONO-ESTERS BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050793-A1 PROCESS FOR PREPARING PHOSPHONIUM SALT ESTERS AS BUILDING BLOCKS FOR CAROTENOIDES BASF SE (DE) 2018-03-22 WO disclosed