SCHEMBL651326

SCHEMBL651326

CCOC(=O)c1cnc2ccc(C(F)(F)F)cc2c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.56
THRB P10828 1/20 0.53
PDE6D O43924 1/20 0.49
PDE6A P16499 1/20 0.49
PDE6G P18545 1/20 0.49
PDE6B P35913 1/20 0.49
PDE6C P51160 1/20 0.49
PDE6H Q13956 1/20 0.49
KDM4E B2RXH2 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAOB P27338 1/20 0.48
MAPT P10636 2/20 0.47
GAA P10253 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
MAPK1 P28482 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL430575 0.90 THRB (0.61) PDE5ATHRBPDE6DPDE6APDE6G
SCHEMBL1983100 0.89 MAPK1 (0.48) PDE5AKDM4EL3MBTL1MAPTGAA
SCHEMBL441445 0.87 PDE5A (0.55) PDE5ATHRBPDE6DPDE6APDE6G
SCHEMBL649687 0.87 PDE5A (0.60) PDE5ATHRBPDE6DPDE6APDE6G
SCHEMBL6197990 0.84 TP53 (0.63) KDM4EL3MBTL1MAPTGAANPSR1
SCHEMBL4428236 0.84 PDE5A (0.56) PDE5ATHRBPDE6DPDE6APDE6G
SCHEMBL538115 0.84 NMT1 (0.61) KDM4EL3MBTL1MAPTGAANPSR1
SCHEMBL1467161 0.83 MAPK1 (0.65) KDM4EL3MBTL1MAPTGAANPSR1
SCHEMBL6200293 0.83 MAPK1 (0.55) KDM4EL3MBTL1MAPTGAANPSR1
SCHEMBL4352879 0.83 MAPT (0.65) PDE5ATHRBL3MBTL1MAPTGAA

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
CN-114751858-B Quinolinyl-containing tranexamic acid derivative and preparation and application thereof 沈阳药科大学 2023-09-12 CN disclosed
CN-114751858-A Quinolinyl-containing tranexamic acid derivative, preparation and application thereof 沈阳药科大学 2022-07-15 CN disclosed
EP-2164328-B1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES DART NEUROSCIENCE CAYMAN LTD (KY) 2013-08-07 EP disclosed
US-8343957-B2 Therapeutic pyrazoloquinoline urea derivatives DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2013-01-01 US disclosed
US-8343957-B2 Therapeutic pyrazoloquinoline urea derivatives DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2013-01-01 US disclosed
US-8119808-B2 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-02-21 US disclosed
US-20110104315-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2011-05-05 US disclosed
US-20110071140-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2011-03-24 US disclosed
US-20110071140-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2011-03-24 US disclosed
US-7884113-B2 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-02-08 US disclosed
US-20080306048-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2008-12-11 US disclosed
US-20080306048-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2008-12-11 US disclosed
US-20080306048-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2008-12-11 US disclosed
US-20080194625-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-08-14 US disclosed
EP-1644335-A4 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2008-06-04 EP disclosed
EP-1644335-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS Bristol-Myers Squibb Company (US) 2006-04-12 EP disclosed
WO-2005007628-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-01-27 WO disclosed
US-20050014786-A1 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2005-01-20 US disclosed
WO-2002000622-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 WO disclosed
US-4450166-A N-(4,5-Dihydro-thiazol-2-yl)-3-quinoline-carboxamides having anxiolytic activity ROUSSEL UCLAF (FR) 1984-05-22 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-20110104315-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS CNR2, CNR1, OPRL1 PDE5A 1747/4885THRB 809/4885PDE6D 2760/4885
US-20080306048-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES GABRB1, GABRA5, GABRB2 PDE5A 198/4885THRB 501/4885PDE6D 1808/4885
US-20110071140-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES GABRB1, GABRA5, GABRB2 PDE5A 198/4885THRB 501/4885PDE6D 1808/4885
US-20050014786-A1 Tetrahydroquinoline derivatives as cannabinoid receptor modulators CNR2, CNR1, OPRL1 PDE5A 1747/4885THRB 809/4885PDE6D 2760/4885
US-20080194625-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS CNR2, CNR1, OPRL1 PDE5A 1747/4885THRB 809/4885PDE6D 2760/4885

“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.