SCHEMBL25136144

SCHEMBL25136144

BC1(NC(=O)c2cc(C3CC3)nc(C3CCCC3)n2)CCCCCCCCCCC1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.37
CNR2 P34972 9/20 0.37
ABL1 P00519 1/20 0.35
PDE2A O00408 4/20 0.34
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CBLB Q13191 3/20 0.32

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
SCHEMBL25136129 1.00 KMO (0.37) KMOCNR2ABL1PDE2ANPC1
SCHEMBL25136085 0.98 KMO (0.37) KMOCNR2ABL1PDE2A
SCHEMBL25136213 0.86 CNR2 (0.33) KMOCNR2ABL1PDE2ANPC1
SCHEMBL25136211 0.86 CBLB (0.40) CBLB
SCHEMBL25136301 0.86 CBLB (0.40) CBLB
SCHEMBL25136058 0.86 CNR2 (0.33) KMOCNR2ABL1PDE2ANPC1
SCHEMBL25136176 0.83 ALDH1A1 (0.36) CNR2PDE2ARAB9A
SCHEMBL25136256 0.83 KMO (0.37) KMOCNR2ABL1CBLB
SCHEMBL25136125 0.82 NPC1 (0.35) CNR2PDE2ANPC1RAB9ACBLB
SCHEMBL25136397 0.82 KHK (0.39) CNR2PDE2ANPC1

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 KMO 3243/4885CNR2 547/4885ABL1 585/4885

“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.