SCHEMBL538115

SCHEMBL538115

CCOC(=O)c1cnc2ccc(F)cc2c1O

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NMT1 P30419 2/20 0.61
NMT2 O60551 1/20 0.61
MAPT P10636 4/20 0.58
NPSR1 Q6W5P4 3/20 0.58
GAA P10253 2/20 0.58
ATM Q13315 2/20 0.58
KDM4E B2RXH2 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.55
MAPK1 P28482 2/20 0.50
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
MAPK10 P53779 1/20 0.47
RXFP1 Q9HBX9 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
SCHEMBL621551 0.90 MAPT (0.53) NMT1NMT2MAPTNPSR1GAA
SCHEMBL1467161 0.86 MAPK1 (0.65) NMT1MAPTNPSR1GAAATM
SCHEMBL6200293 0.86 MAPK1 (0.55) NMT1NMT2MAPTNPSR1GAA
SCHEMBL538191 0.86 NMT2 (0.60) NMT1NMT2MAPTNPSR1GAA
SCHEMBL22395756 0.86 NMT2 (0.60) NMT1NMT2MAPTNPSR1GAA
SCHEMBL30900720 0.86 NMT2 (0.60) NMT1NMT2MAPTNPSR1GAA
SCHEMBL439008 0.86 NMT2 (0.60) NMT1NMT2MAPTNPSR1GAA
SCHEMBL4620616 0.85 MAPT (0.51) NMT1NMT2MAPTNPSR1GAA
SCHEMBL11066821 0.85 MEN1 (0.51) NMT1NMT2MAPTNPSR1GAA
SCHEMBL618410 0.84 MAPT (0.62) NMT1NMT2MAPTNPSR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598159-B2 Therapeutic pyrazoloquinoline derivatives DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2013-12-03 US 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-8343957-B2 Therapeutic pyrazoloquinoline urea derivatives DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2013-01-01 US disclosed
EP-2166852-B1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES HELICON THERAPEUTICS INC (US) 2012-02-08 EP disclosed
EP-2166852-B1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES HELICON THERAPEUTICS INC (US) 2012-02-08 EP 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-20110071140-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2011-03-24 US disclosed
EP-0172004-B1 QUINOLINONES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM The Boots Company PLC (GB) 1990-03-21 EP disclosed
US-4855291-A 1,4dihydroquinoline-3-carboxamides THE BOOTS COMPANY PLC (GB) 1989-08-08 US disclosed
US-4698350-A 1-ethyl-6-fluoro-1,4-dihydro-7-(2,6-dimethyl-4-pyridinyl)-4-oxo-3-quinolinecarboxylic acid and antibacterial use thereof STERLING DRUG INC. (US) 1987-10-06 US disclosed
EP-0179239-A2 7-(Pyridinyl)-/-alkyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid having antibacterial activity and preparation thereof STERLING DRUG INC. (US) 1986-04-30 EP disclosed
EP-0172004-A2 Quinolinones, process for their preparation and pharmaceutical compositions containing them The Boots Company PLC (GB) 1986-02-19 EP 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
US-4312870-A TRANQUILIZERS, ANTIDEPRESSANTS CIBA-GEIGY CORPORATION (US) 1982-01-26 US disclosed
US-4051247-A ANTIBACTERIAL AGENTS RIKER LABORATORIES, INC. (US) 1977-09-27 US disclosed
US-3985753-A ANTIBACTERIAL AGENTS RIKER LABORATORIES, INC. (US) 1976-10-12 US disclosed
US-3976651-A BACTERICIDE RIKER LABORATORIES, INC. (US) 1976-08-24 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 (1 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-20110071140-A1 THERAPEUTIC PYRAZOLOQUINOLINE UREA DERIVATIVES GABRB1, GABRA5, GABRB2 NMT1 2455/4885NMT2 2560/4885MAPT 1171/4885

“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.