SCHEMBL30913963

SCHEMBL30913963

CCCCCC(=O)N[C@H](CO)C[C@@H]1CCNC1=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 1/20 0.49
▸ NOD1 Q9Y239 1/20 0.47
▸ NAAA Q02083 3/20 0.45
▸ CERT1 Q9Y5P4 3/20 0.44
▸ DNM1 Q05193 1/20 0.43
▸ CNR2 P34972 3/20 0.42
▸ CNR1 P21554 3/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ FAAH O00519 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ PLA2G2C Q5R387 1/20 0.41
▸ GNAI3 P08754 1/20 0.40
▸ GNAO1 P09471 1/20 0.40
▸ GNAI1 P63096 1/20 0.40
▸ DEGS1 O15121 1/20 0.40

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
SCHEMBL30913965 0.82 CCR2 (0.47) CCR2NOD1
SCHEMBL24690554 0.81 — —
SCHEMBL25008065 0.80 NAAA (0.42) NAAAMEN1KMT2A
SCHEMBL7417089 0.79 CTSL (0.36) —
SCHEMBL19924782 0.79 CTSL (0.36) —
SCHEMBL6064485 0.79 CTSL (0.36) —
SCHEMBL30913973 0.79 CTSL (0.50) CCR2NOD1
SCHEMBL30913966 0.79 NOD1 (0.49) CCR2NOD1NAAAFAAH
SCHEMBL30913990 0.78 NOD1 (0.44) CCR2NOD1NAAAMEN1KMT2A
SCHEMBL30291526 0.78 CTSL (0.37) CCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118103351-A Coronavirus inhibitors 共晶制药公司 2024-05-28 — — CN disclosed
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