SCHEMBL15067642

SCHEMBL15067642

CCS(=O)(=O)Nc1cc(Br)c(Oc2ccc(F)cc2F)cc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 10/20 0.57
MRGPRX1 Q96LB2 5/20 0.46
KDM4E B2RXH2 2/20 0.45
MAPK14 Q16539 1/20 0.44
EPAS1 Q99814 1/20 0.44
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL16335383 0.96 BRD4 (0.54) BRD4MRGPRX1KDM4EMAPK14EPAS1
Ethane SCHEMBL16335382 0.96 BRD4 (0.54) BRD4MRGPRX1KDM4EMAPK14EPAS1
SCHEMBL15067364 0.90 BRD4 (0.58) BRD4MRGPRX1KDM4EMAPK14EPAS1
SCHEMBL16335277 0.89 BRD4 (0.59) BRD4MRGPRX1KDM4EMAPK14EPAS1
SCHEMBL16335525 0.87 BRD4 (0.55) BRD4MRGPRX1MAPK14EPAS1
SCHEMBL28718898 0.84 EPAS1 (0.47) BRD4MRGPRX1MAPK14EPAS1
SCHEMBL29549178 0.84 EPAS1 (0.47) BRD4MRGPRX1MAPK14EPAS1
SCHEMBL16335784 0.83 BRD4 (0.56) BRD4MRGPRX1MAPK14EPAS1
SCHEMBL16334849 0.83 BRD4 (0.62) BRD4MRGPRX1ALDH1A1HPGD
SCHEMBL29549377 0.83 BRD4 (0.51) BRD4MRGPRX1MAPK14EPAS1HPGD

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 15 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-20190084981-A1 Bromodomain Inhibitors ABBVIE INC (US) 2019-03-21 US disclosed
US-10131657-B2 Bromodomain inhibitors ABBVIE INC. (US) 2018-11-20 US disclosed
US-20180296566-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2018-10-18 US disclosed
US-9957263-B2 Bromodomain inhibitors ABBVIE INC. (US) 2018-05-01 US disclosed
EP-2797918-B1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2017-11-29 EP disclosed
US-20160272630-A1 Bromodomain Inhibitors ABBVIE INC. (US) 2016-09-22 US disclosed
US-20160185769-A1 Bromodomain Inhibitors ABBVIE INC. (US) 2016-06-30 US 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 (9 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 1/4885MRGPRX1 150/4885KDM4E 988/4885
US-20190084981-A1 Bromodomain Inhibitors BRD4, BRD1, BRD3 BRD4 1/4885MRGPRX1 302/4885KDM4E 749/4885
US-20140162971-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885MRGPRX1 150/4885KDM4E 988/4885
US-10131657-B2 Bromodomain inhibitors BRD1, BRD4, BRD3 BRD4 2/4885MRGPRX1 241/4885KDM4E 834/4885
US-20160272630-A1 Bromodomain Inhibitors BRD4, BRDT, EP300 BRD4 1/4885MRGPRX1 703/4885KDM4E 1675/4885
US-20230158039-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885MRGPRX1 150/4885KDM4E 988/4885
US-20160185769-A1 Bromodomain Inhibitors BRD1, BRD4, BRD3 BRD4 2/4885MRGPRX1 241/4885KDM4E 834/4885
US-20160143916-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885MRGPRX1 150/4885KDM4E 988/4885
US-20210236508-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 BRD4 1/4885MRGPRX1 150/4885KDM4E 988/4885

“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.