SCHEMBL3108923

SCHEMBL3108923

Cc1n[nH]c2nccc(Oc3ncc(N(C(=O)C4(C(N)=O)CC4)c4ccc(F)cc4)cc3Cl)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 13/20 0.40
MERTK Q12866 9/20 0.40
MET P08581 13/20 0.36
KDR P35968 3/20 0.34
RET P07949 2/20 0.34
KIT P10721 2/20 0.34
FLT3 P36888 2/20 0.34
PDGFRA P16234 1/20 0.34
AURKA O14965 1/20 0.33
RIPK2 O43353 1/20 0.33
ABCB11 O95342 1/20 0.33
ABL1 P00519 1/20 0.33
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33
NTRK1 P04629 1/20 0.33
LCK P06239 1/20 0.33
PGR P06401 1/20 0.33
LYN P07948 1/20 0.33
CHRM2 P08172 1/20 0.33
HCK P08631 1/20 0.33

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
SCHEMBL3099850 0.92 AXL (0.33) AXLMERTKMETKDRRET
SCHEMBL3111368 0.91 AXL (0.36) AXLMERTKMETKDRRET
SCHEMBL3113836 0.89 MET (0.34) AXLMERTKMETKDRRET
SCHEMBL3100072 0.88 AXL (0.40) AXLMERTKMETKDRTYRO3
SCHEMBL3108895 0.88 AXL (0.40) AXLMERTKMETKDRRET
SCHEMBL3099969 0.87 MET (0.36) AXLMERTKMETKDRRET
SCHEMBL3101845 0.86 MET (0.42) AXLMERTKMETKDRRET
SCHEMBL3114395 0.86 MET (0.37) AXLMERTKMETKDRRET
SCHEMBL3113385 0.86 AXL (0.40) AXLMERTKMETKDRRET
SCHEMBL3104646 0.85 AXL (0.35) AXLMERTKMETKDRRET

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-7723330-B2 Heterobicyclic pyrazole compounds and methods of use ARRAY BIOPHARMA INC. (US) 2010-05-25 US claimed
US-20100256356-A1 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2010-10-07 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-20100256356-A1 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ROR1, CYP11B1, CYP11B2 AXL 117/4885MERTK 285/4885MET 357/4885

“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.