SCHEMBL5141187

SCHEMBL5141187

CC(C)(C)OC(=O)N1CCC(c2cc(-c3ccc4cn(Cc5ccc(F)cc5)nc4c3)c3c(N)ncnn23)CC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYRO3 Q06418 11/20 0.47
▸ MERTK Q12866 5/20 0.44
▸ ACVRL1 P37023 4/20 0.43
▸ AXL P30530 4/20 0.43
▸ RIPK1 Q13546 1/20 0.42

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
SCHEMBL5140759 0.93 MERTK (0.47) TYRO3MERTKACVRL1AXL
SCHEMBL14312964 0.91 MERTK (0.45) TYRO3MERTKACVRL1AXL
SCHEMBL14312672 0.90 TYRO3 (0.53) TYRO3MERTKACVRL1AXL
SCHEMBL14888093 0.90 ACVRL1 (0.47) TYRO3MERTKACVRL1AXL
SCHEMBL14312776 0.90 MERTK (0.45) TYRO3MERTKACVRL1AXLRIPK1
SCHEMBL5141848 0.89 ACVRL1 (0.44) TYRO3MERTKACVRL1AXLRIPK1
SCHEMBL5077710 0.89 MERTK (0.43) TYRO3MERTKACVRL1AXLRIPK1
SCHEMBL14327124 0.89 TYRO3 (0.55) TYRO3MERTKACVRL1AXL
SCHEMBL5077778 0.89 MERTK (0.46) TYRO3MERTKACVRL1AXL
SCHEMBL14313353 0.88 MERTK (0.45) TYRO3MERTKACVRL1AXLRIPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945222-B1 PYRROLO[2,1-F] [1,2,4]-TRIAZIN-4-YLAMINES AS IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES Bayer Pharma AG (DE) 2012-12-26 — — EP disclosed
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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