SCHEMBL30224213

SCHEMBL30224213

COc1ncc(-c2cc(Br)c3nccn3n2)c(OC)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 3/20 0.38
▸ MTOR P42345 2/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ HCK P08631 1/20 0.37
▸ SRC P12931 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ EPHB4 P54760 1/20 0.37
▸ PRKDC P78527 1/20 0.37
▸ PI4KB Q9UBF8 1/20 0.37
▸ QPCT Q16769 1/20 0.36
▸ QPCTL Q9NXS2 1/20 0.36
▸ CYP1A2 P05177 1/20 0.34
▸ METAP2 P50579 1/20 0.34
▸ PTGES2 Q9H7Z7 1/20 0.33
▸ MDM2 Q00987 1/20 0.33
▸ PPARD Q03181 1/20 0.32

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
SCHEMBL23994425 1.00 SYK (0.38) SYKMTORPIK3CDABL1EGFR
SCHEMBL25004812 0.83 SYK (0.45) SYKMTORPIK3CDABL1EGFR
SCHEMBL23994106 0.82 GAA (0.49) SYK
SCHEMBL30224465 0.82 MTOR (0.38) SYKMTORPIK3CDABL1EGFR
SCHEMBL23991557 0.82 MTOR (0.38) SYKMTORPIK3CDABL1EGFR
SCHEMBL23992848 0.81 MTOR (0.39) SYKMTORPIK3CDABL1EGFR
SCHEMBL25005175 0.81 SYK (0.43) SYKMTORPIK3CDABL1EGFR
SCHEMBL30224149 0.81 PLAU (0.38) SYKMTORPIK3CDABL1EGFR
SCHEMBL23992929 0.81 PLAU (0.38) SYKMTORPIK3CDABL1EGFR
SCHEMBL30181730 0.80 MTOR (0.34) SYKMTORPIK3CDABL1EGFR

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-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 — — EP disclosed
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