SCHEMBL14667163

SCHEMBL14667163

Cc1cnc(N)nc1N[C@@H](C)c1cc2cccc(C(F)(F)F)c2c(=O)n1-c1cccc(F)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.52
PIK3CG P48736 8/20 0.52
PIK3R2 O00459 1/20 0.52
PIK3R1 P27986 5/20 0.42
PIK3CA P42336 4/20 0.41
PIK3CB P42338 4/20 0.41
ABCB11 O95342 1/20 0.40
TBXA2R P21731 1/20 0.40
HTR2A P28223 1/20 0.40
PDE3A Q14432 1/20 0.40

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
SCHEMBL14649177 0.93 PIK3CD (0.53) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14667148 0.93 PIK3CD (0.59) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14649514 0.92 PIK3CD (0.53) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14757509 0.90 PIK3CD (0.51) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14726328 0.90 PIK3CD (0.51) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14649530 0.89 PIK3CD (0.53) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14649363 0.86 PIK3CD (0.61) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL18852727 0.86 PIK3CD (0.60) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14649459 0.85 PIK3CD (0.60) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA
SCHEMBL14649275 0.84 PIK3CD (0.49) PIK3CDPIK3CGPIK3R2PIK3R1PIK3CA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9718815-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2017-08-01 US disclosed
US-20150126506-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. 2015-05-07 US disclosed
US-8969363-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2015-03-03 US disclosed
US-20130029982-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLIKINE, LLC (US) 2013-01-31 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-20150126506-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB PIK3CD 2/4885PIK3CG 7/4885PIK3R2 35/4885
US-20130029982-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB PIK3CD 2/4885PIK3CG 7/4885PIK3R2 35/4885

“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.