SCHEMBL23747775

SCHEMBL23747775

CCOC(=O)/C(C#N)=C(/C)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
KMT2A Q03164 4/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 4/20 0.48
LMNA P02545 4/20 0.48
MAPK1 P28482 1/20 0.46
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
KCNJ1 P48048 1/20 0.44
KCNH2 Q12809 1/20 0.44
ESR1 P03372 1/20 0.43
CYP19A1 P11511 1/20 0.43
ESR2 Q92731 1/20 0.43
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL11138252 0.87 MAPT (0.46) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL11138250 0.87 MAPT (0.46) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL26188701 0.86 MAPT (0.62) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL28811683 0.84 MAPT (0.63) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL11110091 0.83 MAPK1 (0.54) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL11110090 0.83 MAPK1 (0.54) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL1554071 0.83 DHODH (0.44) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL1554070 0.83 DHODH (0.44) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL29519656 0.82 MAPT (0.55) MAPTKMT2AALDH1A1KDM4ELMNA
SCHEMBL29015219 0.82 MAPT (0.55) MAPTKMT2AALDH1A1KDM4ELMNA

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 5 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
CN-115515934-A NAMPT modulators 赛特凯恩蒂克公司 2022-12-23 CN disclosed
EP-4100393-A1 NAMPT MODULATORS Cytokinetics, Inc. (US) 2022-12-14 EP 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 MAPT 718/4885KMT2A 1669/4885MEN1 484/4885

“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.