SCHEMBL2914219

SCHEMBL2914219

O=S(=O)(CCl)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
NPC1 O15118 1/20 0.55
CA1 P00915 4/20 0.52
CA2 P00918 4/20 0.52
CA12 O43570 3/20 0.52
CA3 P07451 3/20 0.52
CA4 P22748 3/20 0.52
CA6 P23280 3/20 0.52
CA5A P35218 3/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
CA13 Q8N1Q1 3/20 0.52
CA14 Q9ULX7 3/20 0.52
CA5B Q9Y2D0 3/20 0.52
KDM4E B2RXH2 1/20 0.50
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47

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
SCHEMBL3254088 0.82 ALDH1A1 (0.59) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL426162 0.81 ALDH1A1 (0.52) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL8789025 0.80 ALDH1A1 (0.56) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL198600 0.80 PSIP1 (0.58) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL3412353 0.78 ALDH1A1 (0.54) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL11375991 0.78 GAA (0.61) ALDH1A1CYP3A4CA1CA2CA12
SCHEMBL1595559 0.78 CA2 (0.45) ALDH1A1CYP3A4NPC1CA1CA2
SCHEMBL5720555 0.78 ALDH1A1 (0.54) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL6219614 0.78 ALDH1A1 (0.54) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL11666329 0.78 CA2 (0.57) ALDH1A1CYP3A4NPC1CA1CA2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963337-B1 THIENO[2,3-b]PYRIDINE DERIVATIVES RICHTER GEDEON NYRT (HU) 2010-09-01 EP disclosed
US-20100022521-A1 COMPOUNDS HANSA METALLWERKE AG (DE) 2010-01-28 US disclosed
CN-101341152-A Novel compounds RICHTER GEDEON NYRT (HU) 2009-01-07 CN disclosed
EP-1963337-A1 NEW COMPOUNDS Richter Gedeon NYRT (HU) 2008-09-03 EP disclosed
WO-2007072095-A1 NEW COMPOUNDS RICHTER GEDEON NYRT. (HU) 2007-06-28 WO disclosed
US-4058604-A OR ACARICIDALLY ACTIVE SUBSTANCES CIBA-GEIGY AG (CH) 1977-11-15 US disclosed
US-3988375-A HERBICIDES MONSANTO COMPANY (US) 1976-10-26 US disclosed
US-3980799-A OR ACARICIDALLY ACTIVE SUBSTANCES CIBA-GEIGY AG (CH) 1976-09-14 US disclosed
US-3940412-A 2,4,5-Trichloro- and 2,4,5-tribromoimidazole derivatives and pesticidal compositions containing them CIBA-GEIGY AG (CH) 1976-02-24 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-20100022521-A1 COMPOUNDS GRM5, GRM3, GRM1 ALDH1A1 2931/4885CYP3A4 1629/4885MAPK1 1969/4885

“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.