SCHEMBL5602872

SCHEMBL5602872

CCCCCc1csnn1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.44
ALDH1A1 P00352 1/20 0.36
MIF P14174 1/20 0.36
CYP19A1 P11511 6/20 0.35
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 1/20 0.34
MGLL Q99685 2/20 0.34
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL10385763 0.98 KCNH2 (0.47) KCNH2ALDH1A1MIFCYP19A1KDM4E
SCHEMBL27948903 0.98 KCNH2 (0.47) KCNH2ALDH1A1MIFCYP19A1KDM4E
SCHEMBL27948896 0.98 KCNH2 (0.47) KCNH2ALDH1A1MIFCYP19A1KDM4E
SCHEMBL27918673 0.94
Thiophene SCHEMBL28293930 0.89 KCNH2 (0.41) KCNH2ALDH1A1MIFCYP19A1MGLL
SCHEMBL4722131 0.77
SCHEMBL28136421 0.72 KDM4E (0.46) ALDH1A1KDM4EMGLLL3MBTL1
SCHEMBL20969046 0.71 NOS3 (0.38)
SCHEMBL27863173 0.71 HTR2A (0.42) KCNH2RAB9A
SCHEMBL16804378 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6632775-B1 Synergistic combination including a 3-aryl-1,3,4-thiadiazol-2(3H)-one; nonphytotoxic to agricultural crops ISAGRO RICERCA S.R.L. (IT) 2003-10-14 US claimed
US-5948916-A Arylthiadiazole derivative and antiviral agent containing the same RATIONAL DRUG DESIGN LABORATORIES (JP) 1999-09-07 US claimed
EP-0785193-A1 ARYLTHIADIAZOLE DERIVATIVE AND ANTIVIRAL AGENT CONTAINING THE SAME Rational Drug Design Laboratories (JP) 1997-07-23 EP claimed
CN-109715696-B Fused thiophene-arylthiadiazole polymers, methods of making the same, and uses thereof 康宁股份有限公司 2022-03-04 CN disclosed
US-10759898-B2 Fused thiophene-arylthiadiazole polymers, methods of making such polymers, and uses thereof CORNING INCORPORATED (US) 2020-09-01 US disclosed
US-20180079858-A1 FUSED THIOPHENE-ARYLTHIADIAZOLE POLYMERS, METHODS OF MAKING SUCH POLYMERS, AND USES THEREOF CORNING INCORPORATED 2018-03-22 US disclosed
WO-2018053226-A1 FUSED THIOPHENE-ARYLTHIADIAZOLE POLYMERS, METHODS OF MAKING SUCH POLYMERS, AND USES THEREOF CORNING INCORPORATED (US) 2018-03-22 WO disclosed
US-9023852-B2 1, 2, 4-thiadiazol-5-ylpiperazine derivatives useful in the treatment of neurodegenerative diseases REMYND NV (BE) 2015-05-05 US disclosed
EP-2726470-B1 1,2,4-THIADIAZOL-5-YLPIPERAZINE DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2015-04-29 EP disclosed
US-20140128404-A1 1, 2, 4-Thiadiazol-5-Ylpiperazine derivatives useful in the treatment of neurodegenerative diseases REMYND NV (BE) 2014-05-08 US disclosed
EP-2726470-A1 1, 2, 4 -THIADIAZOL- 5 -YLPIPERAZINE DERIVATIVES USEFUL IN THE TREATMENT NEURODEGENERATIVE DISEASES reMynd NV (BE) 2014-05-07 EP disclosed
US-5948916-A Arylthiadiazole derivative and antiviral agent containing the same RATIONAL DRUG DESIGN LABORATORIES (JP) 1999-09-07 US disclosed
EP-0785193-A1 ARYLTHIADIAZOLE DERIVATIVE AND ANTIVIRAL AGENT CONTAINING THE SAME Rational Drug Design Laboratories (JP) 1997-07-23 EP disclosed
EP-0785193-A1 ARYLTHIADIAZOLE DERIVATIVE AND ANTIVIRAL AGENT CONTAINING THE SAME Rational Drug Design Laboratories (JP) 1997-07-23 EP disclosed
WO-1996009296-A1 ARYLTHIADIAZOLE DERIVATIVE AND ANTIVIRAL AGENT CONTAINING THE SAME RATIONAL DRUG DESIGN LABORATORIES (JP) 1996-03-28 WO disclosed
US-5434164-A Carbostyril derivatives and salts thereof and pharmaceutical compositions for inhibiting adhesion of thrombocytes OTSUKA PHARMACEUTICAL CO. LTD. (JP) 1995-07-18 US disclosed
EP-0240015-B1 Carbostyril derivatives, process for preparing them, pharmaceutical composition, and use OTSUKA PHARMA CO LTD (JP) 1994-12-28 EP disclosed
US-5008274-A Carbostyril derivatives and salts thereof and pharmaceutical composition for inhibiting adhesion of thrombocytes OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-04-16 US disclosed
EP-0240015-A2 Carbostyril derivatives, process for preparing them, pharmaceutical composition, and use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-10-07 EP disclosed
US-4330552-A Antiinflammatory 4,5-diaryl-2-arylthioimidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-05-18 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-20140128404-A1 1, 2, 4-Thiadiazol-5-Ylpiperazine derivatives useful in the treatment of neurodegenerative diseases MAPT, PSEN1, PSEN2 KCNH2 2629/4885ALDH1A1 1098/4885MIF 4027/4885

“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.