SCHEMBL3948797

SCHEMBL3948797

Sc1ccc2cccc3c2c1C=CC3

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
CYP1A2 P05177 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
KDM4E B2RXH2 2/20 0.33
TYMS P04818 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL10542837 0.81 TSHR (0.43) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL28418222 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL3700917 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL27720320 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL23668366 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL25429169 0.79 TSHR (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL20377849 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL23546524 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL8929992 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2
SCHEMBL27755130 0.79 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0216518-B1 FIBER HAVING THERMOPLASTIC RESIN COATING TEIJIN LIMITED (JP) 1992-04-15 EP claimed
EP-0096095-B1 SEMICONDUCTOR DEVICE, SENSOR AND METHOD FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A MEDIUM Ohmicron Corporation (US) 1988-11-09 EP claimed
EP-1795910-B1 Reduction of eddy current losses in electrically conductive samples by means of special NMR sample tubes BRUKER BIOSPIN AG (CH) 2009-01-14 EP disclosed
EP-1856188-A1 SULFONATED POLY(ARYLENES) AS HYDROLYTICALLY AND THERMO-OXIDATIVELY STABLE POLYMERS MPG Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2007-11-21 EP disclosed
EP-1795910-A1 Reduction of eddy current losses in electrically conductive samples by means of special NMR sample tubes Bruker BioSpin AG (CH) 2007-06-13 EP disclosed
WO-2006094767-A1 SULFONATED POLY(ARYLENES) AS HYDROLYTICALLY AND THERMO-OXIDATIVELY STABLE POLYMERS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2006-09-14 WO disclosed
EP-0325061-B1 Process for producing poly (para-phenylene-sulfide) TOSOH CORP (JP) 1995-12-06 EP disclosed
EP-0325061-A3 PROCESS FOR PRODUCING POLY (PARA-PHENYLENE-SULFIDE) Tosoh Corporation (JP) 1991-03-20 EP disclosed
EP-0325061-A2 Process for producing poly (para-phenylene-sulfide) Tosoh Corporation (JP) 1989-07-26 EP disclosed