SCHEMBL30675617

SCHEMBL30675617

Cc1c(Cl)ncc2nc(SCC(=O)Nc3ccc(F)c(O)c3)[nH]c12

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 16/20 0.74
▸ LMNA P02545 2/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48

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
SCHEMBL20679617 1.00 ENPP1 (0.74) ENPP1LMNANPSR1ALDH1A1MEN1
SCHEMBL21663583 0.89 ENPP1 (0.61) ENPP1LMNANPSR1ALDH1A1MEN1
SCHEMBL20679592 0.87 ENPP1 (0.75) ENPP1
SCHEMBL30675608 0.87 ENPP1 (0.75) ENPP1
SCHEMBL30675583 0.86 ENPP1 (0.75) ENPP1
SCHEMBL20679543 0.86 ENPP1 (0.75) ENPP1
SCHEMBL21663415 0.84 ENPP1 (0.70) ENPP1LMNANPSR1ALDH1A1MEN1
SCHEMBL30675581 0.83 ENPP1 (0.74) ENPP1MAPT
SCHEMBL20679568 0.83 ENPP1 (0.74) ENPP1MAPT
SCHEMBL20679534 0.82 ENPP1 (0.85) ENPP1LMNANPSR1

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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