SCHEMBL28990777

SCHEMBL28990777

CCCCCC(O)C(NC(=O)O)c1ccccc1I

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.44
CSNK1E P49674 1/20 0.42
PPARG P37231 2/20 0.39
ASAH1 Q13510 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ACER2 Q5QJU3 1/20 0.39
PRSS1 P07477 2/20 0.38
CTSG P08311 2/20 0.38
CTRB1 P17538 2/20 0.38
CMA1 P23946 2/20 0.38
NAAA Q02083 2/20 0.38
POLB P06746 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
FOLH1 Q04609 1/20 0.36

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
SCHEMBL27992397 0.90 POLB (0.39) CNR2PPARGALDH1A1PRSS1CTSG
SCHEMBL27992292 0.84 TRPA1 (0.37) ALDH1A1POLB
SCHEMBL16054222 0.76 KEAP1 (0.36) ALDH1A1
SCHEMBL20554973 0.76 CNR2 (0.38) CNR2PRSS1CTSGCTRB1CMA1
SCHEMBL28041542 0.76 POLB (0.38) CNR2PPARGALDH1A1PRSS1CTSG
SCHEMBL5046409 0.74 CYSLTR2 (0.44) CNR2PPARGALDH1A1PRSS1CYSLTR2
SCHEMBL10385792 0.74 CYSLTR2 (0.44) CNR2PPARGALDH1A1PRSS1CYSLTR2
SCHEMBL28454212 0.74 CYSLTR2 (0.44) CNR2PPARGALDH1A1PRSS1CYSLTR2
SCHEMBL15050139 0.73 CSNK1E (0.40) CNR2CSNK1EPPARGALDH1A1POLB
SCHEMBL15050136 0.73 CSNK1E (0.40) CNR2CSNK1EPPARGALDH1A1POLB

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
CN-111419830-B Phenylalkylcarbamate compounds for use in the prevention or treatment of epilepsy and epileptic related syndromes 比皮艾思药物研发有限公司 2024-01-30 CN disclosed
CN-115996905-A Phenylalkyl carbamate compounds for use in preventing or treating neurodegenerative diseases 生物药品解决方案有限公司 2023-04-21 CN disclosed