SCHEMBL16043545

SCHEMBL16043545

Cc1[nH]c(-c2ccc(Br)cc2)cc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.55
CDC7 O00311 2/20 0.49
RXFP1 Q9HBX9 1/20 0.46
NOTUM Q6P988 1/20 0.44
EPRS1 P07814 2/20 0.42
MAPK14 Q16539 1/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
DHODH Q02127 1/20 0.41
MYC P01106 1/20 0.41
NR4A1 P22736 1/20 0.41
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CFD P00746 1/20 0.40

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
SCHEMBL16042251 0.85 BRD4 (0.71) BRD4CDC7
SCHEMBL2215320 0.84 BRD4 (0.75) BRD4CDC7NOTUMDHODHKDM4E
SCHEMBL2215748 0.83 MAPK14 (0.58) BRD4CDC7NOTUMMAPK14MEN1
SCHEMBL16045678 0.83 BRD4 (0.55) BRD4CDC7NOTUMCYP1A2KMT2A
SCHEMBL16041651 0.80 PDE3B (0.60) BRD4RXFP1MEN1CYP1A2CYP3A4
SCHEMBL30463801 0.80 MCL1 (0.54) BRD4CDC7NOTUMMAPK14MEN1
SCHEMBL16042550 0.78 CDC7 (0.51) BRD4CDC7MEN1CYP3A4KMT2A
SCHEMBL28689724 0.76 BRD4 (0.48) BRD4CDC7RXFP1NOTUMMEN1
SCHEMBL16042212 0.74 BRD4 (0.52) BRD4NOTUMKMT2AMYC
SCHEMBL4767248 0.74 CDC7 (0.78) CDC7MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970193-B1 PYRROLE AMIDE INHIBITORS ABBVIE INC (US) 2018-07-25 EP disclosed
US-9493411-B2 Pyrrole-3-carboxamide bromodomain inhibitors ABBVIE INC. (US) 2016-11-15 US disclosed
EP-2970193-A1 PYRROLE AMIDE INHIBITORS AbbVie Inc. (US) 2016-01-20 EP disclosed
WO-2014165127-A1 PYRROLE AMIDE INHIBITORS ABBVIE INC. (US) 2014-10-09 WO disclosed
US-20140275079-A1 PYRROLE AMIDE INHIBITORS ABBVIE INC. 2014-09-18 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 (1 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-20140275079-A1 PYRROLE AMIDE INHIBITORS HDAC10, ARG1, CDK20 BRD4 835/4885CDC7 2007/4885RXFP1 678/4885

“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.