SCHEMBL15972708

SCHEMBL15972708

Cc1ccc(C)n1-c1ccc(-c2cc(C(=O)O)c3nn(C)nc3c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.59
MYC P01106 4/20 0.45
CTSB P07858 3/20 0.45
KLKB1 P03952 2/20 0.45
ELANE P08246 1/20 0.45
MMP9 P14780 1/20 0.45
DUSP3 P51452 1/20 0.45
PKM P14618 1/20 0.45
TDP1 Q9NUW8 3/20 0.44
NR4A1 P22736 3/20 0.44
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
HPGD P15428 1/20 0.43
APEX1 P27695 1/20 0.43
NOTUM Q6P988 4/20 0.39
MGLL Q99685 1/20 0.38

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
SCHEMBL17921444 0.87 MYC (0.48) DHODHMYCCTSBKLKB1ELANE
SCHEMBL17910007 0.84 DHODH (0.50) DHODH
SCHEMBL15973841 0.79 MCL1 (0.51) DHODH
SCHEMBL15986658 0.79 DHODH (0.58) DHODHMYCCTSBKLKB1ELANE
SCHEMBL25939461 0.79 DHODH (0.58) DHODHMYCCTSBKLKB1ELANE
SCHEMBL23645717 0.77 DHODH (0.37) DHODH
SCHEMBL17921456 0.77 DHODH (0.52) DHODHMYCCTSBKLKB1ELANE
SCHEMBL25939456 0.77 DHODH (0.52) DHODHMYCCTSBKLKB1ELANE
SCHEMBL17909998 0.75 MAPT (0.41) DHODHCTSBKLKB1TDP1ALDH1A1
SCHEMBL23645576 0.74 DHODH (0.57) DHODHMYCCTSBKLKB1ELANE

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
EP-3417850-A1 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS Aurigene Discovery Technologies Limited (IN) 2018-12-26 EP claimed
EP-3019482-A2 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS Aurigene Discovery Technologies Limited (IN) 2016-05-18 EP claimed
WO-2014128669-A2 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-08-28 WO claimed
US-11717512-B2 Methods of use for trisubstituted benzotriazole derivatives SERVIER PHARMACEUTICALS LLC (US) 2023-08-08 US disclosed
US-11717512-B2 Methods of use for trisubstituted benzotriazole derivatives SERVIER PHARMACEUTICALS LLC (US) 2023-08-08 US disclosed
EP-3915557-A1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS Aurigene Discovery Technologies Limited (IN) 2021-12-01 EP disclosed
EP-3915557-A1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS Aurigene Discovery Technologies Limited (IN) 2021-12-01 EP disclosed
US-11147801-B2 Methods of use for trisubstituted benzotriazole derivatives as dihydroorotate oxygenase inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2021-10-19 US disclosed
EP-3615027-B1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS AURIGENE DISCOVERY TECH LTD (IN) 2021-07-14 EP disclosed
US-20210113531-A1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES SERVIER PHARMACEUTICALS LLC 2021-04-22 US disclosed
WO-2019164794-A1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AGIOS PHARMACEUTICALS, INC. (US) 2019-08-29 WO disclosed
US-20180021311-A1 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2018-01-25 US disclosed
US-20170224663-A1 Methods of Use for Trisubstituted Benzotriazole Derivatives as Dihydroorotate Oxygenase Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-08-10 US disclosed
US-20170224663-A1 Methods of Use for Trisubstituted Benzotriazole Derivatives as Dihydroorotate Oxygenase Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-08-10 US disclosed
US-9630932-B2 Trisubstituted benzotriazole derivatives as dihydroorotate oxygenase inhibitors Um Pharmauji Sdn. Bhd. (MY) 2017-04-25 US disclosed
US-9630932-B2 Trisubstituted benzotriazole derivatives as dihydroorotate oxygenase inhibitors Um Pharmauji Sdn. Bhd. (MY) 2017-04-25 US disclosed
US-20160200693-A1 Trisubstituted Benzotriazole Derivatives as Dihydroorotate Oxygenase Inhibitors Um Pharmauji Sdn. Bhd. (MY) 2016-07-14 US disclosed
US-20160200693-A1 Trisubstituted Benzotriazole Derivatives as Dihydroorotate Oxygenase Inhibitors Um Pharmauji Sdn. Bhd. (MY) 2016-07-14 US disclosed
EP-3019482-A2 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS Aurigene Discovery Technologies Limited (IN) 2016-05-18 EP disclosed
WO-2014128669-A2 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-08-28 WO 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-20180021311-A1 TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS DHODH, DHFR, DPYD DHODH 1/4885MYC 864/4885CTSB 1449/4885
US-11717512-B2 Methods of use for trisubstituted benzotriazole derivatives BRDT, BRPF3, BRD4 DHODH 441/4885MYC 261/4885CTSB 1670/4885
US-20160200693-A1 Trisubstituted Benzotriazole Derivatives as Dihydroorotate Oxygenase Inhibitors DHODH, HAAO, TALDO1 DHODH 1/4885MYC 4400/4885CTSB 2949/4885
US-11147801-B2 Methods of use for trisubstituted benzotriazole derivatives as dihydroorotate oxygenase inhibitors DHODH, DHFR, DDO DHODH 1/4885MYC 1067/4885CTSB 1343/4885
US-20210113531-A1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES BRDT, BRPF3, BRD4 DHODH 441/4885MYC 261/4885CTSB 1670/4885
US-20170224663-A1 Methods of Use for Trisubstituted Benzotriazole Derivatives as Dihydroorotate Oxygenase Inhibitors DHODH, DHFR, DDO DHODH 1/4885MYC 1067/4885CTSB 1343/4885

“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.