SCHEMBL30675585

SCHEMBL30675585

COc1ccc(NC(=O)CSc2nc3cc(C#N)ncc3[nH]2)cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 19/20 1.00
▸ FPR2 P25090 1/20 0.59

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
SCHEMBL20679576 1.00 ENPP1 (1.00) ENPP1FPR2
SCHEMBL30675570 0.93 ENPP1 (1.00) ENPP1FPR2
SCHEMBL20679599 0.93 ENPP1 (1.00) ENPP1FPR2
SCHEMBL20679595 0.87 ENPP1 (1.00) ENPP1
SCHEMBL20679559 0.86 ENPP1 (1.00) ENPP1
SCHEMBL30675556 0.86 ENPP1 (1.00) ENPP1
SCHEMBL20679594 0.84 ENPP1 (1.00) ENPP1
SCHEMBL21670912 0.83 ENPP1 (0.83) ENPP1
SCHEMBL21670895 0.82 ENPP1 (0.70) ENPP1
SCHEMBL20679570 0.80 ENPP1 (0.88) ENPP1FPR2

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-111615388-B Immunotherapeutic agent for cancer 斯汀格瑞治疗股份有限公司 2023-11-14 — — CN disclosed
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