SCHEMBL16558013

SCHEMBL16558013

Cc1nc(-n2nc(Nc3ccc(N4CCN([C@H]5C[C@@H]6CC[C@H]5C6)CC4)cc3)nc2N)c2scc(C)c2n1

nearest known ligand 0.86

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AXL P30530 18/20 0.86
KDR P35968 10/20 0.86
INSR P06213 1/20 0.46
AURKA O14965 1/20 0.41
CDK4 P11802 1/20 0.41

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
SCHEMBL4995124 0.92 AXL (1.00) AXLKDRINSRAURKACDK4
SCHEMBL4993438 0.92 AXL (1.00) AXLKDRINSRAURKACDK4
SCHEMBL4993590 0.92 AXL (1.00) AXLKDRINSRAURKACDK4
SCHEMBL11317396 0.92 AXL (1.00) AXLKDRINSRAURKACDK4
SCHEMBL4992302 0.90 AXL (0.80) AXLKDRINSRAURKACDK4
SCHEMBL4997549 0.90 AXL (0.79) AXLKDRINSR
Formic Acid SCHEMBL4989624 0.89 AXL (0.92) AXLKDRINSRAURKACDK4
SCHEMBL4241756 0.87 AXL (0.80) AXLKDRINSRAURKACDK4
SCHEMBL4989676 0.87 AXL (0.75) AXLKDRINSR
SCHEMBL4238730 0.86 AXL (0.73) AXLKDRINSRAURKACDK4

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
US-20160243085-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS MIDCAP FINANCIAL TRUST 2016-08-25 US disclosed
US-9353126-B2 Substituted triazoles useful as Axl inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-20150072959-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS MIDCAP FINANCIAL TRUST 2015-03-12 US disclosed

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

For each of this compound's patents that has machine-readable text (2 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-20150072959-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS AXL, TYRO3, MERTK AXL 1/4885KDR 70/4885INSR 247/4885
US-20160243085-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS AXL, TYRO3, MERTK AXL 1/4885KDR 70/4885INSR 247/4885

“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.