SCHEMBL16703117

SCHEMBL16703117

CCN1CCC(C)(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PER2 O15055 2/20 0.39
CRY2 Q49AN0 2/20 0.39
CHRM2 P08172 1/20 0.35
CHRM3 P20309 1/20 0.35
INMT O95050 1/20 0.33
AOC2 O75106 1/20 0.33
EHMT2 Q96KQ7 1/20 0.32
CHRNA7 P36544 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL13632872 0.87 PER2 (0.43) PER2CRY2CHRM2CHRM3INMT
SCHEMBL28600143 0.85 PER2 (0.39) PER2CRY2CHRM2CHRM3INMT
SCHEMBL28648812 0.83 PER2 (0.38) PER2CRY2CHRM2CHRM3AOC2
Ammonia Solution, Strong SCHEMBL8031383 0.81 PER2 (0.37) PER2CRY2CHRM2CHRM3AOC2
SCHEMBL27602897 0.79 OPRM1 (0.45) PER2CRY2EHMT2OPRM1OPRD1
SCHEMBL25718283 0.78 CHRM2 (0.33) CHRM2CHRM3INMTCHRNA7OPRM1
SCHEMBL27151618 0.78 INMT (0.35) CHRM2CHRM3INMTCHRNA7OPRM1
SCHEMBL22313302 0.77 CHRM2 (0.43) CHRM2CHRM3INMTCHRNA7OPRM1
SCHEMBL21389132 0.77 PER2 (0.40) PER2CRY2AOC2EHMT2OPRM1
SCHEMBL27743133 0.77 PER2 (0.37) PER2CRY2AOC2EHMT2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024044731-A1 DIAZEPINO-THIENO-QUINOXALINE COMPOUNDS AND THEIR USE IN THERAPY MATCHPOINT THERAPEUTICS INC. (US) 2024-02-29 WO disclosed
EP-3066135-B1 METHOD FOR ISOLATING CARBOHYDRATE ALKYLCARBAMATES CREASEARCH BVBA (BE) 2019-05-15 EP disclosed
US-10113010-B2 Method for isolating carbohydrate alkylcarbamates CREASEARCH BVBA (BE) 2018-10-30 US disclosed
US-20160311936-A1 Method for Isolating Carbohydrate Alkylcarbamates CREASEARCH BVBA (BE) 2016-10-27 US disclosed
EP-3066135-A2 METHOD FOR ISOLATING CARBOHYDRATE ALKYLCARBAMATES Creachem BVBA (BE) 2016-09-14 EP disclosed
WO-2015067595-A2 METHOD FOR ISOLATING CARBOHYDRATE ALKYLCARBAMATES CREACHEM BVBA (BE) 2015-05-14 WO disclosed