SCHEMBL28041744

SCHEMBL28041744

CCC(OCOC)C(NC(=O)O)c1ccccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.40
CTSA P10619 12/20 0.38
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
KCNQ2 O43526 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL28990749 0.87 CASP1 (0.43) CASP1CTSAOPRM1OPRL1MEN1
SCHEMBL28041589 0.86 ABCB1 (0.37) MEN1KMT2A
SCHEMBL28041751 0.85 GAA (0.40) CTSAMEN1KMT2AALDH1A1
SCHEMBL28041525 0.85 CTSA (0.39) CASP1CTSAOPRM1OPRL1MEN1
SCHEMBL27992133 0.77 CASP1 (0.46) CASP1CTSAKCNQ2ALDH1A1
SCHEMBL28990776 0.77 ABCB1 (0.36) MEN1RAB9AKMT2AALDH1A1
SCHEMBL15067314 0.74 POLB (0.41) CASP1CTSAOPRM1OPRL1MEN1
SCHEMBL11244690 0.73 CXCL8 (0.44) CASP1CTSAOPRM1OPRL1MEN1
SCHEMBL23347634 0.73 CASP1 (0.40) CASP1CTSA
SCHEMBL250307 0.73 CASP1 (0.40) CASP1CTSA

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 4 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
CN-104136416-B Phenylalkylamino carbamate derivatives compound and comprise the pharmaceutical composition of this Phenylalkylamino carbamate derivatives compound 比皮艾思药物研发有限公司 2016-11-09 CN disclosed
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