SCHEMBL98107

SCHEMBL98107

[CH2]N1CCc2ccccc2C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.58
MAOB P27338 2/20 0.58
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NOTUM Q6P988 1/20 0.47
TMPRSS2 O15393 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
CYP2D6 P10635 1/20 0.47
SLC6A2 P23975 1/20 0.47
DRD2 P14416 1/20 0.46
DRD1 P21728 1/20 0.46
DRD4 P21917 1/20 0.46
DRD5 P21918 1/20 0.46
DRD3 P35462 1/20 0.46
PHGDH O43175 1/20 0.46
MGLL Q99685 1/20 0.46
MAPT P10636 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
EED O75530 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
SCHEMBL1916638 0.87 MAOA (0.52) MAOAMAOBMEN1KMT2ANOTUM
SCHEMBL1373794 0.82 KMT2A (0.46) MAOAMAOBMEN1KMT2ANOTUM
SCHEMBL29390912 0.73 MAOA (1.00) MAOAMAOBNOTUMHTR1AADRA2A
SCHEMBL98108 0.73 MAOA (1.00) MAOAMAOBNOTUMHTR1AADRA2A
SCHEMBL8307804 0.73 MAOA (0.54) MAOAMAOBMEN1KMT2ANOTUM
Hydrochloric Acid SCHEMBL23501375 0.71 MAOA (1.00) MAOAMAOBNOTUMHTR1AADRA2A
SCHEMBL14886174 0.71 MAOA (0.58) MAOAMAOBMEN1KMT2ANOTUM
SCHEMBL15256256 0.71 MAOA (0.58) MAOAMAOBMEN1KMT2ANOTUM
SCHEMBL302485 0.71 MAOA (0.58) MAOAMAOBMEN1KMT2ANOTUM
SCHEMBL9697633 0.71 MAOA (0.58) MAOAMAOBMEN1KMT2ANOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2008-08-21 US claimed
CN-1317277-C Benzofuran derivatives and their use as pharmaceutical preparations ARPIDA AG (CH) 2007-05-23 CN claimed
EP-1307445-B1 BENZOFURAN DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS ARPIDA AG (CH) 2005-12-21 EP claimed
US-20040034047-A1 Benzofuran derivatives and their use as antibacterial agents EVOLVA SA (CH) 2004-02-19 US claimed
EP-3191484-B1 PYRAZOLOPYRIDINE DERIVATIVES AND THEIR USE IN THERAPY HELMHOLTZ ZENTRUM MUENCHEN DEUTSCHES FORSCHUNGSZENTRUM GESUNDHEIT & UMWELT GMBH (DE) 2024-06-12 EP disclosed
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 US disclosed
US-10138242-B2 Pyrazolopyridine derivatives and their use in therapy HELMHOLTZ ZENTRUM MUENCHEN—DEUTSCHES FORSCHUNGSZENTRUM FUER GESUNDHEIT UND UMWELT GMBH (DE) 2018-11-27 US disclosed
US-20180186789-A1 PYRAZOLOPYRIDINE DERIVATIVES AND THEIR USE IN THERAPY HELMHOLTZ ZENTRUM MUENCHEN DEUTSCHES FORSCHUNGSZENTRUM GESUNDHEIT & UMWELT GMBH (DE) 2018-07-05 US disclosed
US-9840504-B2 Pyrazolopyridine derivatives and their use in therapy HELMHOLTZ ZENTRUM MUENCHEN—DEUTSCHES FORSCHUNGZENTRUM FUER GESUNDHEIT UN (DE) 2017-12-12 US disclosed
US-20170247375-A1 PYRAZOLOPYRIDINE DERIVATIVES AND THEIR USE IN THERAPY HELMHOLTZ ZENTRUM MUNCHEN - DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) (DE) 2017-08-31 US disclosed
EP-3191484-A1 PYRAZOLOPYRIDINE DERIVATIVES AND THEIR USE IN THERAPY Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2017-07-19 EP disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006114606-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2006-11-02 WO disclosed
US-7030130-B2 Benzofuran derivatives and their use as antibacterial agents ARPIDA AG (CH) 2006-04-18 US disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed
EP-1307445-B1 BENZOFURAN DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS ARPIDA AG (CH) 2005-12-21 EP disclosed
US-20040034047-A1 Benzofuran derivatives and their use as antibacterial agents EVOLVA SA (CH) 2004-02-19 US disclosed
EP-0848957-A1 Fas LIGAND SOLUBILIZATION INHIBITOR KANEBO LTD. (JP) 1998-06-24 EP disclosed
EP-0713483-A1 AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES Astra Aktiebolag (SE) 1996-05-29 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 (6 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 MAOA 4309/4885MAOB 3664/4885MEN1 3151/4885
US-20170247375-A1 PYRAZOLOPYRIDINE DERIVATIVES AND THEIR USE IN THERAPY TPP1, PRDX5, TPMT MAOA 1335/4885MAOB 1135/4885MEN1 3884/4885
US-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S CTSS, CTSK, CTSZ MAOA 2112/4885MAOB 1496/4885MEN1 4836/4885
US-20040034047-A1 Benzofuran derivatives and their use as antibacterial agents SBDS, BPTF, DCXR MAOA 1349/4885MAOB 1078/4885MEN1 4413/4885
US-20180186789-A1 PYRAZOLOPYRIDINE DERIVATIVES AND THEIR USE IN THERAPY TPP1, PRDX5, TPMT MAOA 1335/4885MAOB 1135/4885MEN1 3884/4885
US-10138242-B2 Pyrazolopyridine derivatives and their use in therapy TPP1, PRDX5, TPMT MAOA 1335/4885MAOB 1135/4885MEN1 3884/4885

“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.