SCHEMBL672108

SCHEMBL672108

COc1ccc(-c2nnn[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
MPI P34949 1/20 0.47
GFER P55789 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
XDH P47989 1/20 0.47
SCN4A P35499 1/20 0.46
MAPT P10636 3/20 0.44
TP53 P04637 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ATM Q13315 1/20 0.44
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
SCN2A Q99250 1/20 0.42

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
SCHEMBL18758173 0.98 XDH (0.50) KDM4EALDH1A1GAAHPGDMPI
SCHEMBL9462506 0.86 APP (0.50) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL6961694 0.83 ABL1 (0.51) KDM4EALDH1A1XDHMAPTNPC1
SCHEMBL2028396 0.83 ADH5 (0.32)
SCHEMBL13545637 0.82 MAPT (0.61) KDM4EALDH1A1MAPTNPC1RAB9A
SCHEMBL13411813 0.81 ADH5 (0.36)
SCHEMBL1458176 0.81 ALDH1A1 (0.50) KDM4EALDH1A1HPGDTDP1MAPT
SCHEMBL702808 0.80 ALDH1A1 (0.53) KDM4EALDH1A1GAAHPGDMPI
SCHEMBL18383408 0.80 CYP2C9 (0.45) ALDH1A1GAAHPGDTDP1MAPT
SCHEMBL12896131 0.80 NOTUM (0.45) XDHMAPTTP53NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9724673-B2 Supported alkoxylated organotin reactant, preparation and use for heterogeneous-phase synthesis of tetrazoles UNIVERSITE DE NANTES (FR) 2017-08-08 US claimed
EP-2726515-B1 SUPPORTED ALKOXYLATED ORGANOTIN REACTANT, PREPARATION AND USE FOR HETEROGENEOUS-PHASE SYNTHESIS OF TETRAZOLES CENTRE NAT RECH SCIENT (FR) 2015-04-01 EP claimed
US-20140206825-A1 SUPPORTED ALKOXYLATED ORGANOTIN REACTANT, PREPARATION AND USE FOR HETEROGENEOUS-PHASE SYNTHESIS OF TETRAZOLES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-07-24 US claimed
EP-2726515-A1 SUPPORTED ALKOXYLATED ORGANOTIN REACTANT, PREPARATION AND USE FOR HETEROGENEOUS-PHASE SYNTHESIS OF TETRAZOLES Centre National De La Recherche Scientifique (FR) 2014-05-07 EP claimed
WO-2013001235-A1 SUPPORTED ALKOXYLATED ORGANOTIN REACTANT, PREPARATION AND USE FOR HETEROGENEOUS-PHASE SYNTHESIS OF TETRAZOLES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-01-03 WO claimed
US-6576414-B1 PKsp of said first organic silver salt is at least 0.5 lower than the pKsp of said second silver salt; high speed, storage stable EASTMAN KODAK COMPANY 2003-06-10 US claimed
US-6548236-B1 The dye-providing couplers in the multilayers being different in hue, forming at least three dye images of different visible or non-visible colors EASTMAN KODAK COMPANY 2003-04-15 US claimed
US-6426181-B2 THE SECOND SILVER SALT IS A THERMAL FOG INHIBITOR THAT PREVENTS DESORPTION OF SENSITIZING DYES FROM THE IMAGING SILVER HALIDE GRAINS AND IS PREFERABLY A MERCAPTO-HETEROCYCLIC COMPOUND EASTMAN KODAK COMPANY 2002-07-30 US claimed
US-20020015928-A1 Mixtures of organic silver salts in color photothermographic systems IRVING LYN M (US) 2002-02-07 US claimed
EP-3138840-B1 THIADIAZOLIDINE DERIVATIVE AS ANTI-ENTEROVIRUS 71 JIANGSU KANION PHARMACEUTICAL CO LTD (CN) 2020-09-23 EP disclosed
CN-109503505-B Synthesis method of 5-substituted tetrazole compound 浙江工业大学 2020-07-21 CN disclosed
US-10577327-B2 Pyridine based ionic fluoride for catalyzing indole and tetrazole formation KING ABDULAZIZ UNIVERSITY (SA) 2020-03-03 US disclosed
US-10577327-B2 Pyridine based ionic fluoride for catalyzing indole and tetrazole formation KING ABDULAZIZ UNIVERSITY (SA) 2020-03-03 US disclosed
CN-106661009-B Anti- enteric virus71 thiadiazolidine derivative 江苏康缘药业股份有限公司 2019-11-26 CN disclosed
EP-0388967-A1 Aldose reductase inhibitor Wakamoto Pharmaceutical Co., Ltd. (JP) 1990-09-26 EP disclosed
US-4647572-A Iodoallyl and iodopropargyl substituted tetrazoles and anti-microbial compositions thereof MEIJI SEIKA KAISHA, LTD. (JP) 1987-03-03 US disclosed
EP-0039892-B1 SUBSTITUTED PHENYL ETHERS CIBA-GEIGY AG (CH) 1986-12-30 EP disclosed
US-4559354-A ADRENERGIC BLOCKING AGENTS AND STIMULANTS; CARDIOTONIC, ANTIARRHYTHMIA AND INOTROPIC AGENTS CIBA-GEIGY CORPORATION (US) 1985-12-17 US disclosed
EP-0107859-A1 Tetrazole compounds, process for preparing the same and antibacterial and antifungal compositions containing the same as active ingredient MEIJI SEIKA KAISHA LTD. (JP) 1984-05-09 EP disclosed
EP-0039892-A1 Substituted phenyl ethers CIBA-GEIGY AG (CH) 1981-11-18 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 (2 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-10577327-B2 Pyridine based ionic fluoride for catalyzing indole and tetrazole formation FLI1, ABL1, INMT KDM4E 2056/4885ALDH1A1 1278/4885GAA 4236/4885
US-20140206825-A1 SUPPORTED ALKOXYLATED ORGANOTIN REACTANT, PREPARATION AND USE FOR HETEROGENEOUS-PHASE SYNTHESIS OF TETRAZOLES ALK, TST, TEKT1 KDM4E 3246/4885ALDH1A1 861/4885GAA 3403/4885

“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.