SCHEMBL17634149

SCHEMBL17634149

O=C1Nc2ccc(Br)cc2OC1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 9/20 0.46
CREBBP Q92793 2/20 0.40
PGR P06401 1/20 0.39
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
GSK3B P49841 1/20 0.35
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35
KMT2A Q03164 1/20 0.35
CA2 P00918 1/20 0.34
KIF11 P52732 1/20 0.34

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
SCHEMBL17634230 0.90 BRD4 (0.39) BRD4CREBBPPGRCCNB2CDK1
SCHEMBL17633648 0.88 BRD4 (0.46) BRD4CREBBPPGRGSK3BKMT2A
SCHEMBL17634231 0.86 BRD4 (0.47) BRD4CREBBPPGRKMT2ACA2
SCHEMBL17634206 0.85 BRD4 (0.51) BRD4CREBBPPGRKMT2A
SCHEMBL17634129 0.81 BRD4 (0.46) BRD4CREBBPPGRCA2
SCHEMBL17634188 0.81 BRD4 (0.44) BRD4CREBBPPGR
SCHEMBL17634084 0.81 PARP1 (0.49) BRD4CREBBPPGRGSK3BKMT2A
SCHEMBL17634234 0.79 CES1 (0.41) BRD4CREBBP
SCHEMBL17634285 0.78 BRD4 (0.40) BRD4CREBBPPGRGSK3BKMT2A
SCHEMBL17633653 0.77 BRD4 (0.43) BRD4PGR

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-3197900-B1 INHIBITORS OF HIF PROLYL HYDROXYLASE MERCK SHARP & DOHME (US) 2020-02-12 EP disclosed
US-9969752-B2 Inhibitors of HIF prolyl hydroxylase MERCK SHARP & DOHME CORP. (US) 2018-05-15 US disclosed
US-20170233412-A1 INHIBITORS OF HIF PROLYL HYDROXYLASE MERCK SHARP & DOHME CORP. (US) 2017-08-17 US disclosed
EP-3197900-A1 INHIBITORS OF HIF PROLYL HYDROXYLASE Merck Sharp & Dohme Corp. (US) 2017-08-02 EP disclosed
WO-2016049099-A1 INHIBITORS OF HIF PROLYL HYDROXYLASE MERCK SHARP & DOHME CORP. (US) 2016-03-31 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 (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-20170233412-A1 INHIBITORS OF HIF PROLYL HYDROXYLASE HIF1AN, HIF1A, EGLN2 BRD4 3617/4885CREBBP 429/4885PGR 1351/4885

“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.