SCHEMBL18045186

SCHEMBL18045186

CC(C)(O)CCn1c2c(cc(C(=O)Nc3ccc(-c4cn(CC(C)(C)O)c5ncnc(N)c45)cc3)c1=O)C(=O)CCC2

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 9/20 0.45
▸ MET P08581 8/20 0.45
▸ MERTK Q12866 2/20 0.44
▸ FLT3 P36888 10/20 0.44

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
SCHEMBL18045158 0.93 FLT3 (0.49) AXLMETMERTKFLT3
SCHEMBL18045145 0.92 MET (0.54) AXLMETMERTKFLT3
SCHEMBL18045162 0.92 NEK7 (0.41) AXLMETMERTKFLT3
SCHEMBL18044544 0.91 AXL (0.51) AXLMETMERTKFLT3
Trifluoroacetic Acid SCHEMBL18045185 0.89 FLT3 (0.46) AXLMETMERTKFLT3
SCHEMBL18044745 0.88 AXL (0.47) AXLMETMERTKFLT3
SCHEMBL18045133 0.87 AXL (0.45) AXLMETMERTKFLT3
SCHEMBL18045156 0.87 AXL (0.46) AXLMETMERTKFLT3
SCHEMBL18045184 0.87 AXL (0.44) AXLMETMERTKFLT3
SCHEMBL16709400 0.87 MERTK (0.53) AXLMETMERTKFLT3

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
US-9586967-B2 Pyrrolo pyrimidine derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2017-03-07 — — US disclosed
US-20160264579-A1 PYRROLO PYRIMIDINE DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2016-09-15 — — 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 (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-20160264579-A1 PYRROLO PYRIMIDINE DERIVATIVE AXL, FLT3, TYRO3 AXL 1/4885MET 398/4885MERTK 5/4885

“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.

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