SCHEMBL28803246

SCHEMBL28803246

CC(O)C(N)C(=O)NCc1cccc(Cl)c1F

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 9/20 0.51
▸ P2RX7 Q99572 4/20 0.49
▸ ALDH1A1 P00352 1/20 0.47
▸ TARS1 P26639 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CD38 P28907 1/20 0.43
▸ PTGES O14684 1/20 0.41

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
SCHEMBL19208037 1.00 CFD (0.51) CFDP2RX7ALDH1A1TARS1KMT2A
SCHEMBL19236690 1.00 CFD (0.51) CFDP2RX7ALDH1A1TARS1KMT2A
SCHEMBL19208305 0.83 CFD (0.48) CFDP2RX7ALDH1A1KMT2A
SCHEMBL19208304 0.83 CFD (0.48) CFDP2RX7ALDH1A1KMT2A
SCHEMBL28803260 0.82 CFD (0.47) CFDP2RX7ALDH1A1KMT2ACD38
SCHEMBL28803261 0.82 CFD (0.47) CFDP2RX7ALDH1A1KMT2ACD38
SCHEMBL19208432 0.81 CFD (0.50) CFDP2RX7ALDH1A1KMT2ACD38
SCHEMBL19208429 0.81 CFD (0.50) CFDP2RX7ALDH1A1KMT2ACD38
SCHEMBL20971637 0.81 P2RX7 (0.47) CFDP2RX7ALDH1A1KMT2ACD38
SCHEMBL20971636 0.81 P2RX7 (0.47) CFDP2RX7ALDH1A1KMT2ACD38

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-109121414-B Benzopyrazole compounds and analogs thereof 拜奥克里斯特制药公司 2022-07-05 — — CN disclosed
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