SCHEMBL5077154

SCHEMBL5077154

CCCCOC(=O)N1CCC(c2cc(-c3ccc4c(Cl)n(Cc5ccccc5)nc4c3)c3c(N)ncnn23)CC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MERTK Q12866 8/20 0.45
▸ AXL P30530 4/20 0.45
▸ TYRO3 Q06418 12/20 0.42
▸ ACVRL1 P37023 2/20 0.40

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
SCHEMBL14313138 0.89 MERTK (0.47) MERTKAXLTYRO3ACVRL1
SCHEMBL14313010 0.88 ACVRL1 (0.46) MERTKAXLTYRO3ACVRL1
SCHEMBL14312512 0.83 TYRO3 (0.52) MERTKAXLTYRO3ACVRL1
SCHEMBL5081063 0.82 MERTK (0.47) MERTKAXLTYRO3ACVRL1
SCHEMBL14313391 0.82 MERTK (0.47) MERTKAXLTYRO3ACVRL1
SCHEMBL5077790 0.82 TYRO3 (0.47) MERTKAXLTYRO3ACVRL1
SCHEMBL14327120 0.82 TYRO3 (0.53) MERTKAXLTYRO3ACVRL1
SCHEMBL14888090 0.82 ACVRL1 (0.47) MERTKAXLTYRO3ACVRL1
SCHEMBL14313867 0.81 TYRO3 (0.45) MERTKAXLTYRO3ACVRL1
SCHEMBL5137209 0.81 ACVRL1 (0.60) MERTKAXLTYRO3ACVRL1

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-1945222-A2 PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES Bayer HealthCare AG (DE) 2008-07-23 — — EP disclosed
WO-2007056170-A2 PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES BAYER HEALTHCARE AG (DE) 2007-05-18 — — WO disclosed
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