SCHEMBL24211133

SCHEMBL24211133

CCn1c(NC(=O)c2cnc(N)nc2)nc2c(OC)c(OCCC(=O)N3CCN(C)CC3)ccc2c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CB P42338 7/20 0.40
PIK3CD O00329 3/20 0.40
PIK3CA P42336 3/20 0.40
PIK3CG P48736 3/20 0.40
CHRM2 P08172 1/20 0.40
PIK3R1 P27986 1/20 0.40
MTOR P42345 1/20 0.40
RAB27A P51159 1/20 0.40
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
PDE5A O76074 2/20 0.35
PDE6A P16499 2/20 0.35
CAMK2D Q13557 1/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
RAB9A P51151 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
SCHEMBL22163831 0.92 PIK3CB (0.46) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL24211056 0.92 PIK3CB (0.41) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23965975 0.90 PIK3CB (0.40) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23965982 0.89 PIK3CB (0.49) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23965967 0.88 PIK3CB (0.39) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL24211091 0.86 PIK3CB (0.45) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23966148 0.86 PIK3CB (0.41) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23966027 0.86 KMT2A (0.36) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23966018 0.85 PIK3CB (0.49) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2
SCHEMBL23966057 0.85 PIK3CB (0.45) PIK3CBPIK3CDPIK3CAPIK3CGCHRM2

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-20220017505-A1 AMINOQUINAZOLINONE AND AMINOISOQUINOLINONE DERIVATIVES AND APPLICATION THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2022-01-20 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-20220017505-A1 AMINOQUINAZOLINONE AND AMINOISOQUINOLINONE DERIVATIVES AND APPLICATION THEREOF PIK3R5, PIK3CA, PIK3R1 PIK3CB 9/4885PIK3CD 4/4885PIK3CA 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.