SCHEMBL28041748

SCHEMBL28041748

COCC[C@@H](c1ccccc1I)C(C)(C)OC(N)=O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL28041747 0.93 ALDH1A1 (0.31) TSHRLMNAGAA
SCHEMBL28823976 0.90
SCHEMBL28041553 0.90 CYP1A2 (0.33) LMNAGAA
SCHEMBL28041560 0.87
SCHEMBL28041593 0.85 ADRB2 (0.39) TSHRLMNAGAA
SCHEMBL28041724 0.85
SCHEMBL28041725 0.85 ADRB2 (0.39) TSHRLMNAGAA
SCHEMBL28041742 0.85 ALDH1A1 (0.38) LMNAGAA
SCHEMBL28823849 0.79 TRPA1 (0.34)
SCHEMBL28990736 0.76 ADRB1 (0.36) TSHRLMNAGAA

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-105209027-A Phenylalkylcarbamate compounds for use in the prevention or treatment of epilepsy and epilepsy-related syndromes BIO PHARM SOLUTIONS CO LTD 2015-12-30 CN disclosed