SCHEMBL20085209

SCHEMBL20085209

Cc1cc2cc(C(=O)/C(C#N)=C/N(C)C)n(SI)c2cc1C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.39
▸ LMNA P02545 1/20 0.38
▸ RAB9A P51151 5/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ RECQL P46063 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31

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
SCHEMBL20084873 0.91 HPGD (0.36) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL21572168 0.91 NPSR1 (0.37) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL20084119 0.88 HPGD (0.35) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL20084029 0.88 HPGD (0.34) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL21572148 0.87 HPGD (0.34) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL21572131 0.86 HPGD (0.33) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL20085372 0.84 HPGD (0.41) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL20084284 0.84 ALDH1A1 (0.33) HPGDLMNAALDH1A1MAPTMEN1
SCHEMBL20084063 0.84 RAB9A (0.38) HPGDLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL20084024 0.84 HPGD (0.34) HPGDLMNARAB9AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3312172-B1 AMINOPYRAZOLE DERIVATIVES USEFUL AS SRC KINASE INHIBITORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2020-05-06 — — EP disclosed
EP-3312172-A1 AMINOPYRAZOLE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 2018-04-25 — — EP disclosed
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