SCHEMBL4474267

SCHEMBL4474267

CCOC(=O)Nc1ccccc1C(=O)OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
CYP2C19 P33261 1/20 0.74
ALDH1A1 P00352 9/20 0.66
KDM4E B2RXH2 7/20 0.66
KMT2A Q03164 2/20 0.66
GAA P10253 2/20 0.63
HSD17B10 Q99714 5/20 0.62
MEN1 O00255 1/20 0.62
HPGD P15428 3/20 0.59
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.57
ATM Q13315 1/20 0.57
HTT P42858 2/20 0.56
TP53 P04637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
MAPT P10636 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL2860044 0.92 KDM4E (0.68) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL31126834 0.92 KDM4E (0.68) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL27465197 0.88 MEN1 (0.59) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL11370286 0.88 MEN1 (0.59) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL10489819 0.85 KMT2A (0.63) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL19805148 0.85 MEN1 (0.68) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL5442803 0.84 KMT2A (0.71) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL11091761 0.84 CYP1A2 (0.55) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL10874779 0.84 NPC1 (0.68) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E
SCHEMBL28401182 0.84 ALDH1A1 (0.72) CYP1A2SMN1; SMN2CYP2C19ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7632834-B2 Long acting beta-2-agonists and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-12-15 US disclosed
US-20080194550-A1 LONG ACTING BETA-2-AGONISTS AND THEIR USE AS MEDICAMENTS BOUYSSOU THIERRY 2008-08-14 US disclosed
US-7375104-B2 Long acting beta-2-agonists and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-05-20 US disclosed
US-20070066609-A1 Long acting beta-2-agonists and their use as medicaments BOUYSSOU THIERRY 2007-03-22 US disclosed
US-20070037781-A1 Novel combinations of medicaments for the treatment of respiratory diseases containing long-acting beta-agonists and at least one additional active ingredient BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-02-15 US disclosed
US-7160882-B2 Long acting β-2-agonists and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-01-09 US disclosed
US-20050227975-A1 New long acting beta-2-agonists and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-10-13 US disclosed
CN-1653042-A Aminoalcohol derivatives as beta-3 adrenergic receptor agonists FUJISAWA PHARMACEUTICAL CO (JP) 2005-08-10 CN disclosed
US-5654306-A ALZHEIMER'S DISEASE; COGNITION ACTIVATORS; BRAIN AND PSYCHOLOGICAL DISORDERS EISAI CO., LTD. (JP) 1997-08-05 US disclosed
US-5424318-A Piperidine derivative and pharmaceutical composition EISAI CO., LTD. (JP) 1995-06-13 US disclosed
US-5306720-A Treatment of cerebrovascular disorders EISAI CO., LTD. (JP) 1994-04-26 US disclosed
EP-0229391-B1 PIPERIDINE DERIVATE, ITS USE AND PHARMACEUTICAL COMPOSITION CONTAINING IT Eisai Co., Ltd. (JP) 1992-07-29 EP disclosed
US-5118684-A For cardiovascular disorder EISAI CO., LTD. (JP) 1992-06-02 US disclosed
US-5039681-A Cognition activators, brain disorders, psychology EISAI CO., LTD. (JP) 1991-08-13 US disclosed
US-4942169-A COGNITION ACTIVATORS, ANTICHOLINESTERASE EISAI CO., LTD. (JP) 1990-07-17 US disclosed
US-4849431-A ANTICHOLINESTERASE ACTIVITY EISAI CO., LTD. (JP) 1989-07-18 US disclosed
EP-0229391-A1 Piperidine derivate, its use and pharmaceutical composition containing it Eisai Co., Ltd. (JP) 1987-07-22 EP 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 (4 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-20070066609-A1 Long acting beta-2-agonists and their use as medicaments ADRB2, ADRB1, CHRM1 CYP1A2 349/4885SMN1; SMN2 1859/4885CYP2C19 1380/4885
US-20050227975-A1 New long acting beta-2-agonists and their use as medicaments ADRB2, ADRA2A, ADRB1 CYP1A2 185/4885SMN1; SMN2 2334/4885CYP2C19 1381/4885
US-20070037781-A1 Novel combinations of medicaments for the treatment of respiratory diseases containing long-acting beta-agonists and at least one additional active ingredient ADRB2, ADRA2A, ADRB1 CYP1A2 769/4885SMN1; SMN2 1213/4885CYP2C19 3479/4885
US-20080194550-A1 LONG ACTING BETA-2-AGONISTS AND THEIR USE AS MEDICAMENTS ADRB2, ADRB1, CHRM1 CYP1A2 346/4885SMN1; SMN2 1839/4885CYP2C19 1377/4885

“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.