SCHEMBL2053519

SCHEMBL2053519

c1csc(-c2cc[nH]n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.52
ALDH1A1 P00352 4/20 0.52
HPGD P15428 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
MEN1 O00255 2/20 0.52
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
HSD17B10 Q99714 3/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 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
SCHEMBL5469628 0.75 MEN1 (0.33) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL27390465 0.75 MAPT (0.40) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL5473233 0.74 MEN1 (0.33) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL1673128 0.71
SCHEMBL8481298 0.71 GPR119 (0.58) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL4245392 0.69 KDM4E (0.55) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL219657 0.69 KDM4E (0.50) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL498897 0.69 KDM4E (1.00) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL28454459 0.69 RPS6KB2 (0.50) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL29816625 0.68 NPC1 (0.42) KDM4EALDH1A1HPGDMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118026934-A N-azole-4-methylbenzenesulfonamide compound and preparation method and application thereof 安徽理工大学 2024-05-14 CN claimed
EP-2943204-B1 BETA-LACTAMASE INHIBITORS VENATORX PHARMACEUTICALS INC (US) 2019-03-13 EP claimed
CN-105101970-B β -lactamase inhibitor 维纳拓尔斯制药公司 2018-11-20 CN claimed
CN-105101970-A Beta-lactamase inhibitors VENATORX PHARMACEUTICALS INC 2015-11-25 CN claimed
CN-102256969-A Compounds that modulate intracellular calcium CALCIMEDICA INC 2011-11-23 CN claimed
US-20090215189-A1 Sensor of species including toxins and chemical warfare agents MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-08-27 US claimed
US-20090134036-A1 Electrolytic Processing Method and Electrolytic Processing Apparatus EBARA CORPORATION (JP) 2009-05-28 US claimed
WO-2008136805-A2 SENSOR OF SPECIES INCLUDING TOXINS AND CHEMICAL WARFARE AGENTS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2008-11-13 WO claimed
CN-1854128-A Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds MASSACHUSETTS INST TECHNOLOGY (US) 2006-11-01 CN claimed
JP-9227557-A None JP disclosed
JP-9227555-A None JP disclosed
CN-118026934-A N-azole-4-methylbenzenesulfonamide compound and preparation method and application thereof 安徽理工大学 2024-05-14 CN disclosed
CN-111172542-B Silver thin film etching solution composition, etching method and metal pattern forming method 东友精细化工有限公司 2023-04-11 CN disclosed
EP-2563759-B1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC (US) 2022-04-06 EP disclosed
US-4723988-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-02-09 US disclosed
US-4684393-A PLATN GROWTH REGULATORS E. I. DUPONT DE NEMOURS AND COMPANY (US) 1987-08-04 US disclosed
EP-0165753-A2 Herbicidal thiophenesulfonamides and pyridinesulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-12-27 EP disclosed
US-4111941-A Thienyl pyrazole thioamides THE UPJOHN COMPANY (US) 1978-09-05 US disclosed
US-4111941-A Thienyl pyrazole thioamides THE UPJOHN COMPANY (US) 1978-09-05 US disclosed
US-4072498-A HERBICIDES THE UPJOHN COMPANY (US) 1978-02-07 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-20090215189-A1 Sensor of species including toxins and chemical warfare agents ANTXR2, APEX1, MB KDM4E 4183/4885ALDH1A1 1431/4885HPGD 2559/4885

“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.