SCHEMBL28028751

SCHEMBL28028751

CC(C)N=C=NC(C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.38
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL18245075 0.90 TRPA1 (0.30) TRPA1TRPV1
Hydrochloric Acid SCHEMBL1353085 0.79 TRPA1 (0.47) TRPA1TRPV1
Bromide SCHEMBL10663202 0.79 TRPA1 (0.47) TRPA1TRPV1
Carbimide SCHEMBL14718656 0.73 TRPA1 (0.42) TRPA1TRPV1
SCHEMBL7642243 0.71 TRPA1 (0.40) TRPA1TRPV1
SCHEMBL9498704 0.67
SCHEMBL20203690 0.65 TRPA1 (0.52) TRPA1TRPV1
SCHEMBL4732959 0.65 TRPA1 (0.35) TRPA1TRPV1
SCHEMBL9074979 0.65 CYP1A2 (0.38) TRPA1TRPV1
SCHEMBL944822 0.65

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
CN-104781271-A Polynucleotides having bioreversible groups UNIV CALIFORNIA 2015-07-15 CN disclosed