SCHEMBL15067799

SCHEMBL15067799

NS(=O)(=O)c1ccc(NCC2CC2)c(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.53
CA2 P00918 16/20 0.51
CA1 P00915 15/20 0.51
CA9 Q16790 4/20 0.50
PTGER4 P35408 2/20 0.49
CA5A P35218 2/20 0.46
CA7 P43166 2/20 0.46
CA5B Q9Y2D0 2/20 0.46
CA12 O43570 3/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA14 Q9ULX7 1/20 0.45

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
SCHEMBL15068205 0.87 ALDH1A1 (0.56) BRD4CA2CA1CA9PTGER4
SCHEMBL15068130 0.85 BRD4 (0.55) BRD4CA2CA1CA9PTGER4
SCHEMBL15067148 0.83 BRD4 (0.51) BRD4CA2CA1CA9PTGER4
SCHEMBL1700398 0.76 BRD4 (0.48) BRD4CA2CA1CA9PTGER4
SCHEMBL1956219 0.76 MAPT (0.56) BRD4CA2CA1CA9PTGER4
SCHEMBL1956216 0.76 MAPT (0.56) BRD4CA2CA1CA9PTGER4
SCHEMBL1700346 0.75 CA2 (0.51) BRD4CA2CA1CA9CA5A
SCHEMBL1700047 0.75 CA1 (0.51) BRD4CA2CA1CA9CA5A
SCHEMBL1700685 0.75 MAPT (0.55) BRD4CA2CA1CA9CA12
SCHEMBL1700680 0.75 MAPT (0.55) BRD4CA2CA1CA9CA12

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 10 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

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 BRD4 1/4885CA2 2735/4885CA1 1571/4885
US-20140162971-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885CA2 2735/4885CA1 1571/4885
US-20230158039-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885CA2 2735/4885CA1 1571/4885
US-20160143916-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885CA2 2735/4885CA1 1571/4885
US-20210236508-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885CA2 2735/4885CA1 1571/4885

“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.