SCHEMBL7776563

SCHEMBL7776563

CCCCC=C=CCCCCC

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.43
ALDH1A1 P00352 2/20 0.41
THRB P10828 1/20 0.39
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 2/20 0.39
DNM1 Q05193 3/20 0.36
EP300 Q09472 1/20 0.34

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
SCHEMBL5670052 0.97 TSHR (0.48) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL28762181 0.97 TSHR (0.48) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL28762164 0.97 TSHR (0.48) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL28762148 0.97 TSHR (0.48) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL9630620 0.97 TSHR (0.46) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL31509527 0.94 TSHR (0.50) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL6861326 0.94 TSHR (0.50) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL31508798 0.94 TSHR (0.50) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL11533275 0.94 TSHR (0.50) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL31508789 0.94 TSHR (0.50) TSHRTHRBFAAHTRPV1DNM1

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
US-20010020345-A1 Gasoline additive for direct injection gasoline engine NIPPON MITSUBISHI OIL CORPORATION 2001-09-13 US disclosed
EP-1122295-A1 GASOLINE ADDITIVE FOR DIRECT-INJECTION GASOLINE ENGINE Nippon Mitsubishi Oil Corporation (JP) 2001-08-08 EP disclosed