SCHEMBL23747434

SCHEMBL23747434

COc1ccc(CNC(=O)Nc2ccc(CN3CCCC3c3cccnc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 1/20 0.55
OPRK1 P41145 6/20 0.54
OPRM1 P35372 5/20 0.54
MAPT P10636 1/20 0.54
NAMPT P43490 3/20 0.54
OPRD1 P41143 2/20 0.53
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48

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
Nornicotine SCHEMBL26098503 0.93 LMNA (0.51) LMNAKDM4EALDH1A1OPRK1OPRM1
SCHEMBL23747561 0.90 NAMPT (0.57) ALDH1A1OPRK1OPRM1NAMPTNPC1
SCHEMBL23747504 0.89 NPC1 (0.60) KDM4EALDH1A1OPRK1OPRM1MAPT
SCHEMBL23747503 0.89 NPC1 (0.60) KDM4EALDH1A1OPRK1OPRM1MAPT
SCHEMBL31029080 0.86 LMNA (0.58) LMNAKDM4EALDH1A1OPRK1OPRM1
SCHEMBL31043697 0.86 LMNA (0.58) LMNAKDM4EALDH1A1OPRK1OPRM1
SCHEMBL23747564 0.85 NAMPT (0.53) LMNAKDM4ENAMPTNPC1RAB9A
SCHEMBL30361423 0.85 NPC1 (0.60) LMNAALDH1A1OPRK1OPRM1MAPT
SCHEMBL26099386 0.85 NPC1 (0.60) LMNAALDH1A1OPRK1OPRM1MAPT
SCHEMBL23747562 0.84 NPC1 (0.63) KDM4EALDH1A1OPRK1OPRM1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
WO-2021159015-A1 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-08-12 WO 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-20230133132-A1 NAMPT MODULATORS NAMPT, MC4R, SIRT1 LMNA 2810/4885KDM4E 2721/4885ALDH1A1 2019/4885

“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.