SCHEMBL19932702

SCHEMBL19932702

CC(C)(C)OC(=O)N1CCc2c(Cc3ccc(F)cc3)cc(C(=O)NC3CCCCC3)nc2C1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 10/20 0.44
▸ CNR1 P21554 9/20 0.44
▸ ABHD12 Q8N2K0 1/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ DPP4 P27487 1/20 0.40
▸ HPGDS O60760 1/20 0.39
▸ USP30 Q70CQ3 1/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ ABHD6 Q9BV23 1/20 0.39
▸ DNMT3A Q9Y6K1 1/20 0.39

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
SCHEMBL19932701 0.90 CHRM1 (0.43) CNR2CNR1
SCHEMBL28496304 0.90 CHRM1 (0.43) CNR2CNR1
SCHEMBL19932632 0.85 CNR2 (0.47) CNR2CNR1ABHD12DPP4ABHD6
SCHEMBL19925934 0.85 PTGER4 (0.43) CNR2CNR1PARP1HPGDS
SCHEMBL19932597 0.82 ADORA1 (0.44) CNR2CNR1PARP1HPGDS
SCHEMBL22212648 0.78 CNR2 (0.48) CNR2CNR1ABHD12DPP4ABHD6
SCHEMBL21545782 0.77 CHRM1 (0.47) —
SCHEMBL19932638 0.76 CNR2 (0.46) CNR2CNR1ABHD12PARP1DPP4
SCHEMBL19932635 0.74 CHRM1 (0.49) —
SCHEMBL19932547 0.73 CHRM1 (0.46) —

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
EP-3507289-B1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LTD (IN) 2020-07-15 — — EP disclosed
WO-2018042362-A1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2018-03-08 — — WO disclosed
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