SCHEMBL969939

SCHEMBL969939

Sc1nnc(-c2ccncc2)s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.59
HPGD P15428 7/20 0.59
ALDH1A1 P00352 7/20 0.59
HSD17B10 Q99714 4/20 0.59
POLB P06746 1/20 0.55
ALOX15 P16050 1/20 0.55
KMT2A Q03164 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
GAA P10253 1/20 0.45
RCE1 Q9Y256 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PKM P14618 1/20 0.44
HTT P42858 1/20 0.44
MAPK8 P45983 3/20 0.42
MAPK10 P53779 3/20 0.42
MEN1 O00255 2/20 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
SCHEMBL14557099 0.86 KDM4E (0.43) KDM4EHPGDALDH1A1HSD17B10POLB
SCHEMBL10561406 0.84 KDM4E (0.71) KDM4EHPGDALDH1A1HSD17B10POLB
SCHEMBL969040 0.80 ALDH1A1 (0.52) KDM4EALDH1A1POLBKMT2AGAA
SCHEMBL9360268 0.77 GAA (0.60) KDM4EALDH1A1ALOX15KMT2AGAA
SCHEMBL8047389 0.77 CA1 (0.49) KDM4EHPGDALDH1A1HSD17B10ALOX15
SCHEMBL28353374 0.77 ALDH1A1 (0.48) KDM4EALDH1A1POLBKMT2AGAA
SCHEMBL8050989 0.77 ALDH1A1 (0.60) KDM4EHPGDALDH1A1POLBALOX15
SCHEMBL972899 0.77 MGAM (0.60) KDM4EHPGDALDH1A1HSD17B10POLB
SCHEMBL14557095 0.77 SNCA (0.37) KDM4EHPGDALDH1A1HSD17B10KMT2A
SCHEMBL970073 0.76 KDM4E (0.64) KDM4EHPGDALDH1A1HSD17B10ALOX15

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-0285565-B1 2-MERCAPTO-5-PYRIDYL-1,3,4-OXADIAZOLES AND 1,3,4-THIADIAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS NEMATICIDAL AGENTS CIBA-GEIGY AG (CH) 1993-09-15 EP claimed
EP-0285565-A2 2-Mercapto-5-pyridyl-1,3,4-oxadiazoles and 1,3,4-thiadiazoles, process for their preparation and their use as nematicidal agents CIBA-GEIGY AG (CH) 1988-10-05 EP claimed
US-20240025879-A1 PYRIDAZINONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. 2024-01-25 US disclosed
US-20220004099-A1 PHOTOSENSITIVE RESIN COMPOSITION, TRANSFER FILM, CURED FILM, LAMINATE, AND MANUFACTURING METHOD OF TOUCH PANEL FUJIFILM CORPORATION (JP) 2022-01-06 US disclosed
US-9834526-B2 HIV protease inhibitors MERCK SHARP & DOHME CORP. (US) 2017-12-05 US disclosed
US-20160311786-A1 HIV PROTEASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-10-27 US disclosed
EP-3082822-A1 HIV PROTEASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2016-10-26 EP disclosed
WO-2015095276-A1 HIV PROTEASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-06-25 WO disclosed
US-7871982-B2 Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-18 US disclosed
US-20090156512-A1 potent activity against resistant pneumococci MEIJI SEIKA KAISHA, LTD. (JP) 2009-06-18 US disclosed
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 EP disclosed
US-5710146-A ANTIBIOTICS FOR BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
EP-0285565-B1 2-MERCAPTO-5-PYRIDYL-1,3,4-OXADIAZOLES AND 1,3,4-THIADIAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS NEMATICIDAL AGENTS CIBA-GEIGY AG (CH) 1993-09-15 EP disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4894380-A NEMATOCIDES CIBA-GEIGY CORPORATION (US) 1990-01-16 US disclosed
EP-0285565-A2 2-Mercapto-5-pyridyl-1,3,4-oxadiazoles and 1,3,4-thiadiazoles, process for their preparation and their use as nematicidal agents CIBA-GEIGY AG (CH) 1988-10-05 EP disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
US-4640915-A MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-02-03 US disclosed
EP-0090366-A1 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid derivatives, processes for the preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-10-05 EP disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 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 (3 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-20090156512-A1 potent activity against resistant pneumococci H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NAT1, NPM1 KDM4E 3077/4885HPGD 2051/4885ALDH1A1 2976/4885
US-20160311786-A1 HIV PROTEASE INHIBITORS PREP, PRSS1, CTSV KDM4E 607/4885HPGD 2008/4885ALDH1A1 3464/4885
US-20240025879-A1 PYRIDAZINONE COMPOUNDS AND USES THEREOF IL6, IL1B, IL1A KDM4E 3514/4885HPGD 69/4885ALDH1A1 270/4885

“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.