SCHEMBL26848732

SCHEMBL26848732

Cc1sc(-c2ccc(C(F)(F)F)nc2)nc1Cl

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.43
PI4KB Q9UBF8 2/20 0.43
PIK3CD O00329 1/20 0.43
PIK3CB P42338 1/20 0.43
PI4KA P42356 1/20 0.43
PIK3CG P48736 1/20 0.43
CASP3 P42574 1/20 0.41
TRPV4 Q9HBA0 1/20 0.39
TRPV3 Q8NET8 3/20 0.37
KCNH2 Q12809 3/20 0.37
MAP4K4 O95819 1/20 0.36
MINK1 Q8N4C8 1/20 0.36

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
SCHEMBL26848733 0.85 PIK3CA (0.45) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL25407787 0.82 PIK3CA (0.49) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL30567664 0.82 PIK3CA (0.49) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL26847330 0.80 PIK3CD (0.41) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL18003803 0.79 TRPV3 (0.43) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL18003295 0.79 HTR2B (0.44) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL30567657 0.78 RAB9A (0.44) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL25407809 0.78 RAB9A (0.44) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL18003145 0.76 KDM4E (0.46) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL26051112 0.75 PIK3CA (0.43) PIK3CAPI4KBPIK3CDPIK3CBPI4KA

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-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 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-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS SPPL2A, SPPL2B, BACE1 PIK3CA 2018/4885PI4KB 2941/4885PIK3CD 2257/4885

“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.