SCHEMBL3220720

SCHEMBL3220720

CC(C)(C)C1CC(c2cc(-c3ccc(NC(=O)Nc4ncccc4C(F)(F)F)c(F)c3)c3c(N)ncnn23)CCN1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 11/20 0.39
AXL P30530 3/20 0.39
MERTK Q12866 6/20 0.39
ACVRL1 P37023 2/20 0.38
NEK7 Q8TDX7 1/20 0.38

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
SCHEMBL60061 0.87 BTK (0.43) TYRO3AXLMERTKACVRL1NEK7
SCHEMBL841952 0.81 RET (0.44) TYRO3AXLMERTK
SCHEMBL842074 0.81 TYRO3 (0.49) TYRO3AXLMERTK
SCHEMBL58989 0.79 RET (0.43) TYRO3AXL
SCHEMBL5036616 0.76 RET (0.52) TYRO3AXLMERTKACVRL1
SCHEMBL27747228 0.76 BTK (0.46) TYRO3AXLMERTKACVRL1
SCHEMBL841528 0.75 FLT3 (0.43) MERTKACVRL1NEK7
SCHEMBL841527 0.75 FLT3 (0.43) MERTKACVRL1NEK7
SCHEMBL59006 0.74 RET (0.54) TYRO3AXLMERTKACVRL1NEK7
SCHEMBL5031566 0.74 FGFR1 (0.51) TYRO3AXLMERTKACVRL1

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
US-20100063038-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis BAYER HEALTHCARE LLC 2010-03-11 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100063038-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis CDK4, CDKL4, MKI67 TYRO3 2612/4885AXL 2194/4885MERTK 1905/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.