SCHEMBL23917548

SCHEMBL23917548

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 13/20 0.56
KDR P35968 10/20 0.53
PIK3CD O00329 7/20 0.53
PIK3CG P48736 7/20 0.53
SRC P12931 7/20 0.53
ABL1 P00519 6/20 0.53
EGFR P00533 5/20 0.53
HCK P08631 5/20 0.53
PIK3CA P42336 5/20 0.53
PIK3CB P42338 5/20 0.53
MTOR P42345 5/20 0.53
EPHB4 P54760 5/20 0.53
PRKDC P78527 5/20 0.53
PI4KB Q9UBF8 3/20 0.53
BMPR1B O00238 1/20 0.53
PLK4 O00444 1/20 0.53
PIK3C2B O00750 1/20 0.53
CASK O14936 1/20 0.53
GAK O14976 1/20 0.53
EPHB6 O15197 1/20 0.53

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
SCHEMBL23917470 0.96 RET (0.56) RETKDRPIK3CDPIK3CGSRC
SCHEMBL19299495 0.82 RET (0.75) RETKDRPIK3CDPIK3CGSRC
SCHEMBL12422371 0.82 SRC (0.71) RETKDRPIK3CDPIK3CGSRC
SCHEMBL23917468 0.81 RET (0.57) RETKDRPIK3CDPIK3CGSRC
SCHEMBL23917283 0.80 KDR (0.47) RETKDRPIK3CDPIK3CGSRC
SCHEMBL23917226 0.80 NUDT14 (0.55) RETKDRPIK3CDPIK3CGSRC
SCHEMBL23917247 0.80 RET (0.49) RETKDRPIK3CDPIK3CGSRC
SCHEMBL16655685 0.79 PIK3CD (0.67) RETKDRPIK3CDPIK3CGSRC
SCHEMBL19299621 0.78 RET (0.73) RETKDRPIK3CDPIK3CGSRC
SCHEMBL23917204 0.78 RET (0.49) RETKDRPIK3CDPIK3CGSRC

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 RET 753/4885KDR 858/4885PIK3CD 2/4885

“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.