SCHEMBL25136122

SCHEMBL25136122

BC1(NC(=O)c2ccnc(C3CCCC3)n2)CCCCCCCCCC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CD38 P28907 5/20 0.37
CNR2 P34972 8/20 0.36
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CBLB Q13191 2/20 0.34
FPR2 P25090 1/20 0.32
GRM5 P41594 1/20 0.32
DEGS1 O15121 1/20 0.32
ABL1 P00519 1/20 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
SCHEMBL25136099 0.80 ABL1 (0.39) CNR2KDM4EGLAHTTKMT2A
SCHEMBL25135909 0.80 ABL1 (0.39) CNR2KDM4EGLAHTTKMT2A
SCHEMBL25136301 0.80 CBLB (0.40) HTTCBLBGRM5
SCHEMBL25136211 0.80 CBLB (0.40) HTTCBLBGRM5
SCHEMBL25136213 0.80 CNR2 (0.33) CNR2CBLBGRM5DEGS1ABL1
SCHEMBL25135921 0.80 CNR2 (0.38) CNR2KDM4EGLAHTTKMT2A
SCHEMBL25136058 0.80 CNR2 (0.33) CNR2CBLBGRM5DEGS1ABL1
SCHEMBL25136101 0.79 PIM1 (0.37) CNR2KDM4EGLAHTTKMT2A
SCHEMBL25136129 0.79 KMO (0.37) CNR2CBLBABL1
SCHEMBL25136085 0.79 KMO (0.37) CNR2ABL1

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 1/4885CNR2 547/4885KDM4E 1423/4885

“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.