SCHEMBL25675286

SCHEMBL25675286

Cc1cc2nc(N)nn2cc1-c1cn[nH]c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTOR P42345 7/20 0.40
PIK3CA P42336 10/20 0.40
LRRK2 Q5S007 1/20 0.39
PIK3CG P48736 3/20 0.36
FEN1 P39748 1/20 0.36
PIK3CD O00329 2/20 0.36
PIK3CB P42338 1/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34

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
SCHEMBL25646707 0.82 PIK3CA (0.39) MTORPIK3CALRRK2PIK3CGPIK3CD
SCHEMBL936915 0.74 PIK3CG (0.49) PIK3CAPIK3CGPIK3CDPIK3CB
SCHEMBL12909575 0.74 DHFR (0.51) PIK3CAPIK3CGPIK3CD
SCHEMBL30042556 0.73 CHEK1 (0.39) PIK3CALRRK2PIK3CGPIK3CD
SCHEMBL25675424 0.73 PIK3CG (0.52) PIK3CAPIK3CGPIK3CDPIK3CB
SCHEMBL30728843 0.73 CHEK1 (0.50)
Hydrochloric Acid SCHEMBL937520 0.73 DHFR (0.50) PIK3CAPIK3CGPIK3CD
SCHEMBL25271218 0.73 JAK2 (0.40) PIK3CAPIK3CGPIK3CDPIK3CB
SCHEMBL25271242 0.72 FLT3 (0.47)
SCHEMBL25228087 0.72 FLT3 (0.47)

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-20230183251-A1 BICYCLIC AMINES AS CDK12 INHIBITORS INCYTE CORPORATION 2023-06-15 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-20230183251-A1 BICYCLIC AMINES AS CDK12 INHIBITORS CDK12, CDK1, CDK2 MTOR 349/4885PIK3CA 499/4885LRRK2 526/4885

“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.