SCHEMBL1372147

SCHEMBL1372147

CN1CCN(C(=O)c2ccco2)CC1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.75
ALDH1A1 P00352 11/20 0.71
NPSR1 Q6W5P4 3/20 0.71
HTT P42858 2/20 0.71
MAPK1 P28482 1/20 0.69
POLB P06746 1/20 0.66
TSHR P16473 3/20 0.65
LMNA P02545 2/20 0.65
TP53 P04637 1/20 0.65
MAPT P10636 1/20 0.63
ALOX15 P16050 1/20 0.63
GAA P10253 1/20 0.63
HSD17B10 Q99714 1/20 0.61
KDM4E B2RXH2 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61

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
SCHEMBL16026437 0.91 ALDH1A1 (0.83) ALDH1A1NPSR1HTTMAPK1POLB
SCHEMBL13804475 0.86 ALDH1A1 (0.71) CYP1A2ALDH1A1NPSR1HTTMAPK1
SCHEMBL3099181 0.84 ALDH1A1 (0.73) ALDH1A1NPSR1HTTMAPK1POLB
SCHEMBL1372144 0.84 ALDH1A1 (0.73) ALDH1A1NPSR1HTTMAPK1POLB
SCHEMBL12846701 0.83 HTT (0.71) ALDH1A1NPSR1HTTMAPK1POLB
SCHEMBL3093579 0.83 ALDH1A1 (0.71) ALDH1A1NPSR1HTTMAPK1POLB
SCHEMBL4748498 0.82 ALDH1A1 (0.87) CYP1A2ALDH1A1NPSR1HTTMAPK1
SCHEMBL61103 0.82 ALDH1A1 (0.87) CYP1A2ALDH1A1NPSR1HTTMAPK1
SCHEMBL4544770 0.82 ALDH1A1 (0.65) CYP1A2ALDH1A1NPSR1HTTMAPK1
SCHEMBL13612640 0.82 ALDH1A1 (0.72) ALDH1A1NPSR1HTTMAPK1POLB

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 99 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9212147-B2 Dihydroxy aromatic heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-12-15 US claimed
US-20140336165-A1 DIHYDROXY AROMATIC HETEROCYCLIC COMPOUND ASTELLAS PHARMA INC. (JP) 2014-11-13 US claimed
WO-2022125989-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS SCRIPPS RESEARCH INSTITUTE, THE (US) 2022-06-16 WO disclosed
EP-3912973-A2 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE Dana-Farber Cancer Institute, Inc. (US) 2021-11-24 EP disclosed
EP-3536687-B1 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE DANA FARBER CANCER INST INC (US) 2021-07-14 EP disclosed
WO-2021072475-A1 DERIVATIVES OF 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-N-(PYRIDIN-3-YL) PYRIMIDIN-2- AMINE FOR TREATING PROLIFERATIVE DISEASES AND CONDITIONS AUCENTRA THERAPEUTICS PTY LTD (AU) 2021-04-22 WO disclosed
EP-3536687-A1 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE Dana Farber Cancer Institute, Inc. (US) 2019-09-11 EP disclosed
EP-3150593-B1 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE DANA FARBER CANCER INST INC (US) 2019-04-24 EP disclosed
EP-2964616-B1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2017-05-03 EP disclosed
EP-3150593-A1 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE Dana Farber Cancer Institute, Inc. (US) 2017-04-05 EP disclosed
EP-1696912-B1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2016-05-11 EP disclosed
US-20070093509-A1 Non-basic melanin concentrating hormone receptor-1 antagonists BRISTOL-MYERS SQUIBB COMPANY 2007-04-26 US disclosed
US-20070055064-A1 Process for the crystallisation of guandinium salts MERCK PATENT GMBH (DE) 2007-03-08 US disclosed
US-20070055064-A1 Process for the crystallisation of guandinium salts MERCK PATENT GMBH (DE) 2007-03-08 US disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
US-20070043095-A1 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use IPSEN PHARMA S.A.S. (FR) 2007-02-22 US disclosed
US-20070010531-A1 Substituted pyrazole compounds MERCK PATENT GMBH (DE) 2007-01-11 US disclosed
US-20070010531-A1 Substituted pyrazole compounds MERCK PATENT GMBH (DE) 2007-01-11 US disclosed
WO-2004099125-A1 METHOD FOR CRYSTALLIZING GUANIDINIUM SALTS MERCK PATENT GMBH (DE) 2004-11-18 WO disclosed
WO-2003007959-A1 QUINOXALINE DERIVATIVES WHICH HAVE PARP INHIBITORY ACTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-01-30 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 (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-20070055064-A1 Process for the crystallisation of guandinium salts GMPS, GUCY1A2, GUCY1A1 CYP1A2 495/4885ALDH1A1 1522/4885NPSR1 2189/4885
US-20070010531-A1 Substituted pyrazole compounds HTR3A, HTR1A, HTR1D CYP1A2 204/4885ALDH1A1 897/4885NPSR1 20/4885
US-20070043095-A1 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use SSTR2, SSTR5, SSTR3 CYP1A2 637/4885ALDH1A1 812/4885NPSR1 31/4885
US-20070093509-A1 Non-basic melanin concentrating hormone receptor-1 antagonists MCHR1, MCHR2, MC1R CYP1A2 861/4885ALDH1A1 622/4885NPSR1 20/4885
US-20140336165-A1 DIHYDROXY AROMATIC HETEROCYCLIC COMPOUND DAO, DDO, DDC CYP1A2 159/4885ALDH1A1 117/4885NPSR1 697/4885

“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.