SCHEMBL21462991

SCHEMBL21462991

CCCC=C(C)C(C)=C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL21462990 1.00 TSHR (0.30) TSHRALDH1A1
SCHEMBL1056887 0.97
SCHEMBL4024981 0.97
SCHEMBL1056886 0.97
SCHEMBL1352862 0.82 TSHR (0.37) TSHRALDH1A1
SCHEMBL1352863 0.82 TSHR (0.37) TSHRALDH1A1
SCHEMBL23222899 0.79 BACE1 (0.35)
SCHEMBL10342809 0.77
SCHEMBL10342810 0.77
SCHEMBL15955013 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019198904-A1 NON-POLYMERIC TACROLIMUS DRUG-ELUTING STENT AND MANUFACTURING METHOD THEREFOR 전남대학교산학협력단 2019-10-17 WO disclosed
CN-103038309-A Singlet harvesting with organic molecules for optoelectronic devices CYNORA GMBH 2013-04-10 CN disclosed