SCHEMBL25409385

SCHEMBL25409385

COc1ccc(-c2cc(N)n(C)n2)cn1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KLK3 P07288 6/20 0.57
F2 P00734 1/20 0.51
MKNK1 Q9BUB5 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
PIK3CA P42336 4/20 0.47
KCNH2 Q12809 4/20 0.45
JAK2 O60674 1/20 0.45
PIK3CD O00329 1/20 0.45
PIP5K1C O60331 1/20 0.45
PIK3CB P42338 1/20 0.45
PI4KA P42356 1/20 0.45
PIK3CG P48736 1/20 0.45
PI4KB Q9UBF8 1/20 0.45
FYN P06241 1/20 0.44
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43
MTOR P42345 1/20 0.43
CYP2A6 P11509 1/20 0.43
CYP19A1 P11511 1/20 0.43

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
SCHEMBL26847558 0.84 KLK3 (0.45) KLK3F2MKNK1MKNK2PIK3CA
SCHEMBL1855101 0.81 KLK3 (0.67) KLK3F2MKNK1MKNK2PIK3CA
SCHEMBL30567671 0.79 NPC1 (0.42) KLK3PIK3CAPIK3CDPIK3CBPI4KA
SCHEMBL25406780 0.79 NPC1 (0.42) KLK3PIK3CAPIK3CDPIK3CBPI4KA
SCHEMBL2684806 0.78 LOX (0.42) KLK3MTORCYP19A1
SCHEMBL15729859 0.77 NPC1 (0.57)
SCHEMBL1853581 0.76 KLK3 (0.61) KLK3F2MKNK1MKNK2PIK3CA
SCHEMBL13874174 0.76 KEAP1 (0.49) KLK3MKNK1MKNK2JAK2FYN
SCHEMBL12279466 0.76 CYP19A1 (0.55) FYNHSD17B1HSD17B2CYP2A6CYP19A1
SCHEMBL1559052 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4578451-A2 COMPOUNDS AND COMPOSITIONS AS SPPL2A INHIBITORS Novartis AG (CH) 2025-07-02 EP disclosed
EP-4214210-B1 COMPOUNDS AND COMPOSITIONS AS SPPL2A INHIBITORS NOVARTIS AG (CH) 2025-04-09 EP disclosed
US-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 US disclosed
US-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 US disclosed
US-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 US disclosed
CN-116615425-A Compounds and compositions as Sppl2a inhibitors 诺华股份有限公司 2023-08-18 CN disclosed
EP-4214210-A1 COMPOUNDS AND COMPOSITIONS AS SPPL2A INHIBITORS Novartis AG (CH) 2023-07-26 EP 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 KLK3 839/4885F2 1579/4885MKNK1 841/4885

“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.