SCHEMBL15067191

SCHEMBL15067191

CS(=O)(=O)c1ccc(Oc2ccccc2)c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.54
HPSE Q9Y251 1/20 0.52
PTGS2 P35354 2/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
MAPT P10636 5/20 0.50
LMNA P02545 3/20 0.50
MAPK1 P28482 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MLNR O43193 1/20 0.50
MMP1 P03956 1/20 0.50
MPO P05164 1/20 0.50
CYP1A2 P05177 1/20 0.50
GLA P06280 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
CYP19A1 P11511 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL9453022 0.88 PTPN1 (0.51) PTPN1MAPTLMNASMN1; SMN2ALDH3A1
SCHEMBL17374551 0.86 PTPN1 (0.52) PTPN1HPSEPTGS2MEN1KMT2A
SCHEMBL7823786 0.85 HPSE (0.55) PTPN1HPSEPTGS2MEN1KMT2A
SCHEMBL15067835 0.85 TDP1 (0.55) PTPN1HPSEMEN1KMT2AMAPT
SCHEMBL1341447 0.83 L3MBTL1 (0.66) MEN1KMT2AMAPTLMNAHPGD
SCHEMBL31512184 0.83 L3MBTL1 (0.50) PTPN1PTGS2MEN1KMT2AMAPT
SCHEMBL27165598 0.83 L3MBTL1 (0.50) PTPN1PTGS2MEN1KMT2AMAPT
SCHEMBL10949671 0.81 MEN1 (0.68) PTPN1PTGS2MEN1KMT2AMAPT
SCHEMBL10953376 0.81 PTPN1 (0.50) PTPN1PTGS2MEN1KMT2AMAPT
SCHEMBL15646828 0.81 PGR (0.60) PTPN1MEN1KMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230158039-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2023-05-25 US disclosed
US-20210236508-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2021-08-05 US disclosed
CN-106986872-B Bromodomain inhibitors 艾伯维公司 2020-04-21 CN disclosed
US-20180296566-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2018-10-18 US disclosed
EP-2797918-B1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2017-11-29 EP disclosed
US-20160143916-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2016-05-26 US disclosed
US-9296741-B2 Bromodomain inhibitors ABBVIE INC. (US) 2016-03-29 US disclosed
EP-2797918-A1 BROMODOMAIN INHIBITORS AbbVie Inc. (US) 2014-11-05 EP disclosed
US-20140162971-A1 BROMODOMAIN INHIBITORS ABBVIE INC. 2014-06-12 US disclosed
WO-2013097601-A1 BROMODOMAIN INHIBITORS ABBVIE INC. (US) 2013-07-04 WO disclosed
WO-2013097052-A1 BROMODOMAIN INHIBITORS ABBOTT LABORATORIES (US) 2013-07-04 WO 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 (5 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-20180296566-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PTPN1 1196/4885HPSE 4290/4885PTGS2 1807/4885
US-20140162971-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PTPN1 1196/4885HPSE 4290/4885PTGS2 1807/4885
US-20230158039-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PTPN1 1196/4885HPSE 4290/4885PTGS2 1807/4885
US-20160143916-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PTPN1 1196/4885HPSE 4290/4885PTGS2 1807/4885
US-20210236508-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PTPN1 1196/4885HPSE 4290/4885PTGS2 1807/4885

“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.