SCHEMBL19862549

SCHEMBL19862549

CC(C)N1CCCC1c1cccc(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
ALDH1A1 P00352 1/20 0.44
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
ADAM17 P78536 1/20 0.42
CHRNA7 P36544 1/20 0.41
MDM2 Q00987 2/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL23449295 0.84 DRD2 (0.44) CHRNA7
SCHEMBL24493509 0.84 HRH3 (0.45) MAPK1
SCHEMBL27111350 0.83 DRD2 (0.46) ALDH1A1MAOAMAOBCHRNA7
SCHEMBL24775490 0.83 DRD2 (0.46) ALDH1A1MAOAMAOBCHRNA7
SCHEMBL21725645 0.82 RIPK1 (0.54) MAOAMAOBTSHR
SCHEMBL4100913 0.82 RIPK1 (0.54) MAOAMAOBTSHR
SCHEMBL19862551 0.81 PARP1 (0.42) CHRNA7MDM2
SCHEMBL19862566 0.81 PARP1 (0.42) CHRNA7MDM2
SCHEMBL24775502 0.81 DRD2 (0.50) ALDH1A1CHRNA7
SCHEMBL14213446 0.80 CHRNB2 (0.59) CHRNA7

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 7 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-11179399-B2 6-heterocyclyl-4-morpholin-4-ylpyridine-2-one compounds useful for the treatment of cancer and diabetes SPRINT BIOSCIENCE AB (SE) 2021-11-23 US disclosed
US-20210161906-A1 6-HETEROCYCLYL-4-MORPHOLIN-4-YLPYRIDINE-2-ONE COMPOUNDS USEFUL FOR THE TREATMENT OF CANCER AND DIABETES SPRINT BIOSCIENCE AB (SE) 2021-06-03 US disclosed
US-20210094950-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH 2021-04-01 US disclosed
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 US disclosed
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 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 (5 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-20210161906-A1 6-HETEROCYCLYL-4-MORPHOLIN-4-YLPYRIDINE-2-ONE COMPOUNDS USEFUL FOR THE TREATMENT OF CANCER AND DIABETES CDK6, IL6, CDK4 MAPK1 432/4885ALDH1A1 1187/4885MAOA 2706/4885
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE PDE3A, PDE2A, PDE5A MAPK1 1503/4885ALDH1A1 436/4885MAOA 132/4885
US-20230133132-A1 NAMPT MODULATORS NAMPT, MC4R, SIRT1 MAPK1 846/4885ALDH1A1 2019/4885MAOA 1897/4885
US-11179399-B2 6-heterocyclyl-4-morpholin-4-ylpyridine-2-one compounds useful for the treatment of cancer and diabetes CDK6, IL6, CDK4 MAPK1 432/4885ALDH1A1 1187/4885MAOA 2706/4885
US-20210094950-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE CSNK1A1, CSNK1E, CSNK1G3 MAPK1 105/4885ALDH1A1 4302/4885MAOA 1312/4885

“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.