SCHEMBL27896445

SCHEMBL27896445

O=CNC1CC(O)CN1C(=O)CC1CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.30
▸ SCN9A Q15858 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
SCHEMBL27879617 0.76 NR1H2 (0.30) —
SCHEMBL27879637 0.75 CTSS (0.42) —
SCHEMBL27879615 0.74 PREP (0.35) —
SCHEMBL27879619 0.74 TSHR (0.44) —
SCHEMBL28799525 0.69 OPRK1 (0.35) SCN9A
SCHEMBL27896420 0.69 NAPRT (0.42) —
SCHEMBL28054810 0.69 PIK3CD (0.55) —
SCHEMBL27879627 0.69 VHL (0.65) —
SCHEMBL27896388 0.69 KMT2A (0.45) —
SCHEMBL12824052 0.67 POLB (0.36) ATM

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-102791693-B Hepatitis c virus inhibitors BRISTOL-MYERS SQUIBB CO. (US) 2016-04-13 — — CN claimed
CN-102791693-A Hepatitis c virus inhibitors BRISTOL MYERS SQUIBB CO 2012-11-21 — — CN claimed
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