SCHEMBL16658356

SCHEMBL16658356

Cc1ccc(-c2cn(C)c(=O)c3ccccc23)cc1S(=O)(=O)NCc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 13/20 0.76
POLB P06746 3/20 0.56
KDM4E B2RXH2 1/20 0.55
APAF1 O14727 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
BRD2 P25440 1/20 0.53
BRD3 Q15059 1/20 0.53
USP2 O75604 1/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CASP6 P55212 1/20 0.51
LMNA P02545 1/20 0.50
BRDT Q58F21 1/20 0.48

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
SCHEMBL16650468 0.86 BRD4 (1.00) BRD4HPGDCYP2C19BRD2BRD3
SCHEMBL29848286 0.86 BRD4 (1.00) BRD4HPGDCYP2C19BRD2BRD3
SCHEMBL29848933 0.82 BRD4 (1.00) BRD4BRDT
SCHEMBL16650591 0.82 BRD4 (1.00) BRD4BRDT
SCHEMBL16651198 0.78 BRD4 (1.00) BRD4HPGDBRD2BRD3SMN1; SMN2
SCHEMBL29848739 0.78 BRD4 (1.00) BRD4HPGDBRD2BRD3SMN1; SMN2
SCHEMBL16658359 0.77 BRD4 (0.76) BRD4POLBKDM4EHPGD
SCHEMBL29848861 0.77 BRD4 (0.81) BRD4HPGDBRD2BRD3SMN1; SMN2
SCHEMBL16650048 0.77 BRD4 (0.81) BRD4HPGDBRD2BRD3SMN1; SMN2
SCHEMBL16651098 0.76 BRD4 (1.00) BRD4BRDT

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-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 (3 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-20150111885-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 BRD4 5/4885POLB 586/4885KDM4E 137/4885
US-20150183784-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 BRD4 5/4885POLB 586/4885KDM4E 137/4885
US-20160115134-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 BRD4 5/4885POLB 586/4885KDM4E 137/4885

“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.