SCHEMBL6004679

SCHEMBL6004679

COc1cc2nccc(Cl)c2cc1OC(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.51
▸ PDGFRB P09619 1/20 0.47
▸ PDGFRA P16234 1/20 0.47
▸ FGFR2 P21802 1/20 0.46
▸ EGFR P00533 2/20 0.45
▸ BMPR1B O00238 1/20 0.44
▸ GAK O14976 1/20 0.44
▸ EPHB6 O15197 1/20 0.44
▸ RIPK2 O43353 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ LCK P06239 1/20 0.44
▸ EPHA1 P21709 1/20 0.44
▸ EPHA8 P29322 1/20 0.44
▸ ACVR1 Q04771 1/20 0.44
▸ MAP2K5 Q13163 1/20 0.44
▸ COQ8A Q8NI60 1/20 0.44
▸ NLK Q9UBE8 1/20 0.44
▸ CGAS Q8N884 1/20 0.43
▸ NCF1 P14598 1/20 0.43
▸ KRAS P01116 1/20 0.43

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
SCHEMBL359988 0.89 SRC (0.60) SRCPDGFRBPDGFRAFGFR2EGFR
SCHEMBL29387468 0.89 SRC (0.60) SRCPDGFRBPDGFRAFGFR2EGFR
SCHEMBL29576504 0.89 SRC (0.60) SRCPDGFRBPDGFRAFGFR2EGFR
Hydrochloric Acid SCHEMBL6432173 0.88 SRC (0.58) SRCPDGFRBPDGFRAFGFR2EGFR
SCHEMBL25239127 0.87 SRC (0.50) SRCPDGFRBPDGFRAFGFR2EGFR
SCHEMBL6004164 0.81 CGAS (0.59) SRCPDGFRBPDGFRAEGFRBMPR1B
SCHEMBL24008989 0.81 SRC (0.58) SRCPDGFRBPDGFRAEGFRBMPR1B
SCHEMBL4499366 0.81 ENPP1 (0.62) SRCPDGFRBPDGFRAEGFRBMPR1B
SCHEMBL31457635 0.81 SRC (0.52) SRCPDGFRBPDGFRAEGFRBMPR1B
SCHEMBL22441533 0.81 SRC (0.52) SRCPDGFRBPDGFRAEGFRBMPR1B

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
EP-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 — — EP disclosed
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