SCHEMBL20084128

SCHEMBL20084128

Cc1cc2cc(C(=O)/C(C#N)=C/N(C)C)n(I)c2cc1NSCCCF

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ LMNA P02545 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
SCHEMBL20084115 0.90 RAB9A (0.31) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20084345 0.85 HPGD (0.36) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20085372 0.80 HPGD (0.41) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20084362 0.80 ALDH1A1 (0.34) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20084283 0.79 HPGD (0.35) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20084112 0.79 RAB9A (0.31) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20084066 0.79 ALDH1A1 (0.30) RAB9AALDH1A1HPGD
SCHEMBL21970500 0.78 RAB9A (0.31) RAB9AALDH1A1HPGDNPC1L3MBTL1
SCHEMBL20084129 0.78 — —
SCHEMBL20084976 0.77 HPGD (0.38) RAB9AALDH1A1HPGDNPC1L3MBTL1

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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