SCHEMBL9467732

SCHEMBL9467732

C=CCCCCCC=CCCCCCCCCCCC=C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
MAPT P10636 2/20 0.48
ABCC4 O15439 1/20 0.48
ALDH1A1 P00352 4/20 0.47
TRPA1 O75762 2/20 0.44
LPAR3 Q9UBY5 2/20 0.41
LMNA P02545 2/20 0.41
LPAR2 Q9HBW0 1/20 0.41
USP2 O75604 2/20 0.39
CYP3A4 P08684 1/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL4597377 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL4597375 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL4597762 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL9467899 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL25185226 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL5051785 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL25185962 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL25185227 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL4597760 1.00 TSHR (0.58) TSHRMAPTABCC4ALDH1A1TRPA1
SCHEMBL25178942 0.97 TSHR (0.55) TSHRMAPTABCC4ALDH1A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5227551-A Higher olefin copolymer EXXON CHEMICAL PATENTS INC. (US) 1993-07-13 US disclosed