SCHEMBL30675616

SCHEMBL30675616

O=C(CSc1nc2cc(C(F)(F)F)ncc2[nH]1)Nc1ccc(OC(F)(F)F)c(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 20/20 1.00

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
SCHEMBL20679606 1.00 ENPP1 (1.00) ENPP1
SCHEMBL20687566 0.94 ENPP1 (0.88) ENPP1
SCHEMBL20679570 0.85 ENPP1 (0.88) ENPP1
SCHEMBL30675565 0.85 ENPP1 (0.88) ENPP1
SCHEMBL20679569 0.81 ENPP1 (0.88) ENPP1
SCHEMBL30675561 0.81 ENPP1 (0.88) ENPP1
SCHEMBL20687581 0.79 ENPP1 (0.76) ENPP1
SCHEMBL30675607 0.78 ENPP1 (0.88) ENPP1
SCHEMBL20679578 0.78 ENPP1 (0.88) ENPP1
SCHEMBL20679579 0.78 ENPP1 (1.00) ENPP1

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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