SCHEMBL30006237

SCHEMBL30006237

Cc1cc(-c2cc(F)cc3cc[nH]c23)c(C(F)(F)F)c2c1NC(C)(C)c1nnc(C)n1-2

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 14/20 0.44
▸ PGR P06401 11/20 0.44
▸ ATR Q13535 2/20 0.32
▸ NR3C2 P08235 2/20 0.32
▸ AR P10275 2/20 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
SCHEMBL23647842 1.00 NR3C1 (0.44) NR3C1PGRATRNR3C2AR
SCHEMBL30005485 0.89 NR3C1 (0.44) NR3C1PGRATRNR3C2AR
SCHEMBL23648079 0.89 NR3C1 (0.44) NR3C1PGRATRNR3C2AR
SCHEMBL23647741 0.85 — —
SCHEMBL30005987 0.85 — —
SCHEMBL21636680 0.81 NR3C1 (0.33) NR3C1PGRATRNR3C2AR
SCHEMBL29821070 0.81 NR3C1 (0.33) NR3C1PGRATRNR3C2AR
SCHEMBL24767040 0.80 — —
SCHEMBL21624395 0.78 NR3C1 (0.36) NR3C1PGRATR
SCHEMBL23648066 0.78 NR3C1 (0.36) NR3C1PGRATR

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-4090660-A1 QUINOXALINE DERIVATIVES Grünenthal GmbH (DE) 2022-11-23 — — EP disclosed
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