SCHEMBL16658367

SCHEMBL16658367

CC(C)(C)c1cc(F)cc(NS(C)(=O)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.47
KIF11 P52732 3/20 0.42
BRD4 O60885 1/20 0.42
NR3C2 P08235 1/20 0.41
ACLY P53396 2/20 0.41
CTSD P07339 1/20 0.40
BACE1 P56817 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
KEAP1 Q14145 1/20 0.38

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
SCHEMBL14200237 0.87 ACLY (0.50) EPHX2KIF11NR3C2ACLYTRPV1
SCHEMBL1733478 0.82 BRD4 (0.49) KIF11BRD4ACLYKEAP1
SCHEMBL12115602 0.82 GABRA1 (0.52) EPHX2NR3C2ACLYTRPV1NR1H4
SCHEMBL16658370 0.82 KIF11 (0.53) EPHX2KIF11BRD4NR3C2ACLY
SCHEMBL19047495 0.80 EPHX2 (0.43) EPHX2KIF11NR3C2ACLYTRPV1
SCHEMBL4953823 0.79 EPHX2 (0.42) EPHX2KIF11NR3C2ACLYTRPV1
SCHEMBL26682976 0.77 RAPGEF4 (0.41)
SCHEMBL19047494 0.76 EPHX2 (0.40) EPHX2KIF11NR3C2ACLYTRPV1
SCHEMBL13802151 0.76 BRD4 (0.44) KIF11BRD4KEAP1
SCHEMBL25005829 0.75 MEN1 (0.35) KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10941160-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2021-03-09 US disclosed
US-20200148703-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-05-14 US disclosed
US-10562915-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-02-18 US disclosed
US-10023592-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-07-17 US disclosed
US-10023592-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-07-17 US disclosed
US-20170158709-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2017-06-08 US disclosed
US-20170158709-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2017-06-08 US disclosed
US-9598372-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-03-21 US disclosed
US-9598372-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-03-21 US disclosed
US-20160115134-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-04-28 US disclosed
US-9115114-B2 Bromodomain inhibitors Quanticel Pharmaceuticals, Inc. (US) 2015-08-25 US disclosed
US-20150183784-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2015-07-02 US disclosed
US-9034900-B2 Bromodomain inhibitors Quanticel Pharmaceuticals, Inc. (US) 2015-05-19 US disclosed
US-20150111885-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2015-04-23 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 (8 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-20170158709-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-10562915-B2 Bromodomain inhibitors BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-20150111885-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-10023592-B2 Bromodomain inhibitors BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-10941160-B2 Bromodomain inhibitors BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-20150183784-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-20200148703-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885
US-20160115134-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 EPHX2 2808/4885KIF11 2647/4885BRD4 5/4885

“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.