SCHEMBL3176276

SCHEMBL3176276

O=S(=O)(Nc1ccccc1)c1ccon1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.50
IL1RN P18510 1/20 0.50
ERAP1 Q9NZ08 1/20 0.50
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
PKM P14618 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CA2 P00918 3/20 0.43
CA12 O43570 3/20 0.43
CA9 Q16790 3/20 0.43
CA1 P00915 2/20 0.43
NR1I2 O75469 1/20 0.41
PFKFB3 Q16875 1/20 0.40
PGR P06401 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL22619001 0.81 PFKFB3 (0.41) KMT2AMEN1ALDH1A1CA2CA12
SCHEMBL22928041 0.78 EGFR (0.42) ALDH1A1CA2PFKFB3PGRPOLB
SCHEMBL6403890 0.72 HTR6 (0.50) PKMALDH1A1CA2CA12CA9
SCHEMBL8557579 0.70
SCHEMBL8164647 0.70 GLO1 (0.55) KEAP1IL1RNERAP1KMT2AMEN1
SCHEMBL22928232 0.69 SMN1; SMN2 (0.40) KMT2AMEN1ALDH1A1GAAMAPT
Biphenyl SCHEMBL5706278 0.69 CA2 (0.47) CA2CA12CA9CA1
SCHEMBL11004258 0.68 MEN1 (0.35) KMT2AMEN1ALDH1A1PFKFB3POLB
SCHEMBL3477694 0.68 BRD4 (0.52) KEAP1IL1RNERAP1KMT2AMEN1
SCHEMBL7416555 0.68 PKM (0.46) PKMALDH1A1CA12CA9NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10435364-B2 Compounds for use as bromodomain inhibitors ALBERT LUDWIGS UNIVERSITÄT FREIBURG (DE) 2019-10-08 US disclosed
EP-2996689-A1 COMPOUNDS FOR USE AS BROMODOMAIN INHIBITORS Albert-Ludwigs-Universität Freiburg (DE) 2016-03-23 EP disclosed
US-20160068485-A1 COMPOUNDS FOR USE AS BROMODOMAIN INHIBITORS ALBERT LUDWIGS UNIVERSITÄT FREIBURG (DE) 2016-03-10 US disclosed
WO-2014170350-A1 COMPOUNDS FOR USE AS BROMODOMAIN INHIBITORS ALBERT LUDWIGS UNIVERSITÄT FREIBURG (DE) 2014-10-23 WO disclosed
EP-2792355-A1 Compounds for use as bromodomain inhibitors Albert-Ludwigs-Universität Freiburg (DE) 2014-10-22 EP disclosed
US-20100022568-A1 ENDOTHELIN RECEPTOR ANTAGONISTS FOR EARLY STAGE IDIOPATHIC PULMONARY FIBROSIS Actelion Pharmaceeuticals Ltd. (CH) 2010-01-28 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 (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-20160068485-A1 COMPOUNDS FOR USE AS BROMODOMAIN INHIBITORS BRD1, BRDT, BRD4 KEAP1 1254/4885IL1RN 178/4885ERAP1 894/4885
US-10435364-B2 Compounds for use as bromodomain inhibitors BRD1, BRDT, BRD4 KEAP1 1254/4885IL1RN 178/4885ERAP1 894/4885

“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.