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Sugi Predict / Compounds / SCHEMBL4590050

SCHEMBL4590050

SCHEMBL4590050

CN(C)CCN1CCN(CCCCCOc2ccc3c(c2)ncn3-c2ccc(Cl)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 10/20 0.60
▸ SRC P12931 7/20 0.60
▸ HRH3 Q9Y5N1 9/20 0.46

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
SCHEMBL4589924 0.87 FGFR1 (0.50) FGFR1SRCHRH3
SCHEMBL4590150 0.86 FGFR1 (0.54) FGFR1SRCHRH3
SCHEMBL4590774 0.84 HRH3 (0.45) FGFR1SRCHRH3
SCHEMBL4591158 0.83 HRH3 (0.46) HRH3
SCHEMBL4588823 0.82 FGFR1 (0.45) FGFR1SRCHRH3
SCHEMBL4590580 0.81 FGFR1 (0.51) FGFR1SRCHRH3
SCHEMBL4590536 0.79 FGFR1 (0.46) FGFR1SRCHRH3
SCHEMBL4589930 0.78 FGFR1 (0.49) FGFR1SRCHRH3
SCHEMBL4589926 0.78 FGFR1 (0.49) FGFR1SRCHRH3
SCHEMBL4590540 0.77 FGFR1 (0.44) FGFR1SRCHRH3

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
WO-2008107322-A1 INDOLE, BENZIMIDAZOLE OR BENZOTRIAZOLE DERIVATIVES INCLUDING A PIPERIDINE OR PIPERAZINE CORE AS ANTI-NEOPLASIC AGENTS OR CELL PROLIFERATION INHIBITORS CEREP (FR) 2008-09-12 — — WO claimed
WO-2008107322-A1 INDOLE, BENZIMIDAZOLE OR BENZOTRIAZOLE DERIVATIVES INCLUDING A PIPERIDINE OR PIPERAZINE CORE AS ANTI-NEOPLASIC AGENTS OR CELL PROLIFERATION INHIBITORS CEREP (FR) 2008-09-12 — — WO disclosed