SCHEMBL23917226

SCHEMBL23917226

Cn1nc(-c2cc3cc(F)c(Oc4ccccc4)cc3[nH]2)c2c(N)ncnc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT14 O95848 1/20 0.55
NUDT5 Q9UKK9 1/20 0.55
RET P07949 12/20 0.54
KDR P35968 8/20 0.48
SRC P12931 6/20 0.48
ABL1 P00519 5/20 0.48
PIK3CD O00329 7/20 0.48
PIK3CA P42336 7/20 0.48
PIK3CB P42338 7/20 0.48
PIK3CG P48736 7/20 0.48
PRKDC P78527 7/20 0.48
EGFR P00533 4/20 0.48
HCK P08631 4/20 0.48
MTOR P42345 4/20 0.48
EPHB4 P54760 4/20 0.48
BMPR1B O00238 1/20 0.44
PLK4 O00444 1/20 0.44
PIK3C2B O00750 1/20 0.44
CASK O14936 1/20 0.44
GAK O14976 1/20 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
SCHEMBL16655696 0.84 RET (0.54) NUDT14NUDT5RETKDRPIK3CD
SCHEMBL23917247 0.81 RET (0.49) RETKDRSRCABL1PIK3CD
SCHEMBL16665690 0.81 PIK3CD (0.39) NUDT14NUDT5RETKDRSRC
SCHEMBL16655326 0.80 PIK3CD (0.56) RETKDRPIK3CDLCKLYN
SCHEMBL23917548 0.80 RET (0.56) RETKDRSRCABL1PIK3CD
SCHEMBL16655897 0.80 RET (0.54) NUDT14NUDT5RETKDRPIK3CD
SCHEMBL22692814 0.79 NUDT14 (0.72) NUDT14NUDT5KDRSRCABL1
SCHEMBL19299621 0.79 RET (0.73) RETKDRSRCABL1PIK3CD
SCHEMBL23917470 0.78 RET (0.56) RETKDRSRCABL1PIK3CD
SCHEMBL23917204 0.78 RET (0.49) RETKDRSRCABL1PIK3CD

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-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 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-20210317140-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB NUDT14 1479/4885NUDT5 1329/4885RET 753/4885

“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.