SCHEMBL20084030

SCHEMBL20084030

Cc1cc2cc(C(=O)/C(C#N)=C/N(C)C)n(SI)c2cc1NSN1CCOCC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL20084076 0.92 ALDH1A1 (0.31) HPGDRAB9AL3MBTL1
SCHEMBL21572151 0.85 HPGD (0.30) HPGD
SCHEMBL20084119 0.85 HPGD (0.35) HPGDRAB9AL3MBTL1
SCHEMBL20084284 0.84 ALDH1A1 (0.33) HPGD
SCHEMBL20084029 0.82 HPGD (0.34) HPGDRAB9AL3MBTL1
SCHEMBL20085209 0.81 HPGD (0.39) HPGDRAB9AL3MBTL1
SCHEMBL21971575 0.81 — —
SCHEMBL21572175 0.81 HPGD (0.31) HPGD
SCHEMBL21572148 0.79 HPGD (0.34) HPGDRAB9AL3MBTL1
SCHEMBL21572170 0.79 KIT (0.34) HPGDRAB9A

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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