SCHEMBL2519554

SCHEMBL2519554

O=C(O)c1cccc2c1C(=O)OC2(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
LMNA P02545 3/20 0.55
TYMS P04818 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX15 P16050 2/20 0.55
HSD17B10 Q99714 2/20 0.55
MAPT P10636 2/20 0.55
ESR1 P03372 1/20 0.55
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
TSHR P16473 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ESR2 Q92731 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
GPR55 Q9Y2T6 1/20 0.55
DHFR P00374 2/20 0.55
GAA P10253 1/20 0.48
PKM P14618 1/20 0.48
MMP2 P08253 1/20 0.46

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
SCHEMBL9168306 0.83 MEN1 (0.50) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL10889354 0.83 TYMS (0.56) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL3378483 0.81 TYMS (0.61) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL20832 0.80 ALDH1A1 (0.60) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL1648480 0.79 TYMS (0.58) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL11443116 0.79 TYMS (0.58) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL9258357 0.79 TYMS (0.58) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL5999539 0.78 ALDH1A1 (0.66) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL9395623 0.78 TYMS (0.65) ALDH1A1LMNATYMSMEN1KMT2A
SCHEMBL11031498 0.77 ALOX5 (0.49) ALDH1A1LMNAMEN1KMT2AALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110251075-A1 SYSTEM AND METHOD FOR THE ANALYSIS OF BODILY FLUIDS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-10-13 US disclosed
EP-2230314-A1 Method of sensing an analyte The Board of Regents,The University of Texas System (US) 2010-09-22 EP disclosed
US-20080219891-A1 PORTABLE SENSOR ARRAY SYSTEM MCDEVITT JOHN T 2008-09-11 US disclosed
US-7316899-B2 Portable sensor array system THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-01-08 US disclosed
US-6982262-B2 Combination of cyamemazine and an atypical neuroleptic AVENTIS PHARMA S. A. (FR) 2006-01-03 US disclosed
US-20050136548-A1 System and method for the analysis of bodily fluids BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2005-06-23 US disclosed
US-20040167125-A1 Combination of cyamemazine and an atypical neuroleptic AVENTIS PHARMA S.A. (FR) 2004-08-26 US disclosed
US-6720318-B2 Combination of cyamemazine and an atypical neuroleptic AVENTIS PHARMA S. A. (FR) 2004-04-13 US disclosed
US-6713298-B2 DEVICE FOR DETECTING PARTICLES IN FLUID BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2004-03-30 US disclosed
US-6649403-B1 Placing particle in a cavity using automated dispenser; covering so that a channel is formed for fluid flow; signals; use for detection of analytes, toxins, and/or bacteria in medical, food/beverage, and environmental solutions BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEMS 2003-11-18 US disclosed
US-5462991-A Pthalein-type ROBOTTI KARLA M (US) 1995-10-31 US disclosed
US-5384411-A Phthalien dyes HEWLETT-PACKARD COMPANY (US) 1995-01-24 US disclosed
EP-0519198-A2 Immobilization of PH-sensitive dyes to solid supports Hewlett-Packard Company (US) 1992-12-23 EP disclosed
US-4755599-A 3-phenyl-2-propeneamine derivatives, their preparation and composition containing them RHONE-POULENC SANTE (FR) 1988-07-05 US disclosed
US-4686309-A ANTIDEPRESSANTS RHONE-POULENC SANTE (FR) 1987-08-11 US disclosed
US-4584297-A Pyrrolo[1,2-c]-1,3-thiazines RHONE-POULENC SANTE (FR) 1986-04-22 US disclosed
US-4576954-A Anti-rheumatic 5-(substituted amino)-1,2-dithiol-3-one compounds and their use PHONE-POULENC SANTE (FR) 1986-03-18 US disclosed
US-4546100-A Pyrrolo[1,2-c]thiazoles useful as antithrombotic agents RHONE-POULENC SANTE (FR) 1985-10-08 US disclosed
US-4529728-A 1H,3H-pyrrolo[1,2-c]thiazole derivatives having anti-allergic and anti-inflammatory activity RHONE-POULENC SANTE (FR) 1985-07-16 US disclosed
US-4271167-A ANTHELMINTICS RHONE-POULENC INDUSTRIES (FR) 1981-06-02 US disclosed