SCHEMBL25136240

SCHEMBL25136240

Cn1cncc1-c1nccc(C(=O)N[C@H]2CC[C@H](C)CC2)n1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD38 P28907 9/20 0.59
CYP2D6 P10635 1/20 0.46
CYP2B6 P20813 1/20 0.46
CYP2C19 P33261 1/20 0.46
TNKS O95271 1/20 0.42
CNR2 P34972 3/20 0.40
CNR1 P21554 2/20 0.40
GRM5 P41594 1/20 0.40
NPC1 O15118 2/20 0.39
KAT2B Q92831 1/20 0.39
LMNA P02545 1/20 0.39
MAPKAPK2 P49137 1/20 0.39

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
SCHEMBL29182248 1.00 CD38 (0.59) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL30363874 1.00 CD38 (0.59) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL30834330 0.88 CD38 (0.61) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL29182272 0.88 CD38 (0.61) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL25136248 0.88 CD38 (0.61) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL25136093 0.87 CD38 (0.45) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL25136035 0.87 CD38 (0.48) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL25136026 0.87 CD38 (0.45) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL30363917 0.87 CD38 (0.45) CD38CYP2D6CYP2B6CYP2C19TNKS
SCHEMBL29182246 0.87 CD38 (0.45) CD38CYP2D6CYP2B6CYP2C19TNKS

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-20230116972-A1 CD38 MODULATORS AND METHODS OF USE THEREOF CYTOKINETICS, INC. 2023-04-20 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-20230116972-A1 CD38 MODULATORS AND METHODS OF USE THEREOF CD38, CXCR4, FCGRT CD38 1/4885CYP2D6 1605/4885CYP2B6 2184/4885

“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.