SCHEMBL31029043

SCHEMBL31029043

O=C(Nc1ccc(CN2CCCC2c2cccnc2)cc1)OCc1ccncc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 5/20 0.53
OPRM1 P35372 4/20 0.53
OPRD1 P41143 2/20 0.51
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 3/20 0.49
HTT P42858 2/20 0.49
GAA P10253 2/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
HPGD P15428 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
NAMPT P43490 1/20 0.44

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
SCHEMBL31043597 1.00 OPRK1 (0.53) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31043970 0.94 OPRK1 (0.52) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31029084 0.94 OPRK1 (0.52) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31029080 0.91 LMNA (0.58) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31043584 0.91 OPRK1 (0.63) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31043697 0.91 LMNA (0.58) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31029220 0.91 OPRK1 (0.63) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31029055 0.87 OPRK1 (0.51) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31029133 0.87 OPRK1 (0.51) OPRK1OPRM1OPRD1ALDH1A1KDM4E
SCHEMBL31029109 0.84 OPRK1 (0.56) OPRK1OPRM1OPRD1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638433-A1 NAMPT MODULATORS Cytokinetics, Inc. (US) 2025-10-29 EP disclosed
US-20240279215-A1 NAMPT MODULATORS CYTOKINETICS, INCORPORATED 2024-08-22 US disclosed
WO-2024137981-A1 NAMPT MODULATORS CYTOKINETICS, INCORPORATED (US) 2024-06-27 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-20240279215-A1 NAMPT MODULATORS NAMPT, SIRT1, NNT OPRK1 3011/4885OPRM1 3013/4885OPRD1 2558/4885

“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.