SCHEMBL2116352

SCHEMBL2116352

Nc1cnc(OCC2CC2)c(Br)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.39
CNR2 P34972 3/20 0.36
CCNA2 P20248 5/20 0.35
CCNA1 P78396 5/20 0.35
CDK1 P06493 4/20 0.35
CCNB1 P14635 3/20 0.35
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
CCNB2 O95067 2/20 0.34
CCNB3 Q8WWL7 2/20 0.34
MAPK3 P27361 1/20 0.34
CLK1 P49759 1/20 0.34
CDK5 Q00535 1/20 0.34
PIN1 Q13526 1/20 0.34
MAP3K5 Q99683 1/20 0.34
EP300 Q09472 2/20 0.33
DHFR P00374 1/20 0.33
BRD4 O60885 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL15633570 0.80 APP (0.38) CDK2CNR2CCNA2CCNA1CDK1
SCHEMBL21940468 0.80 SCN9A (0.39) CDK2CNR2CCNA2CCNA1CDK1
SCHEMBL20652788 0.80 EP300 (0.39) CDK2CNR2CCNA2CCNA1ALOX5AP
SCHEMBL15633140 0.80 KDM4E (0.38) CDK2CNR2CCNA2CCNA1EP300
SCHEMBL14823455 0.80 OPRK1 (0.37) CDK2CNR2CCNA2CCNA1EP300
SCHEMBL15067934 0.80 BRD4 (0.47) CDK2CNR2CCNA2CCNA1CDK1
SCHEMBL21940549 0.76 CNR2 (0.39) CDK2CNR2ALOX5APFEN1
SCHEMBL28853251 0.76 CNR1 (0.40) CNR2THRATHRB
SCHEMBL16046248 0.75 HPGD (0.38) CDK2CDK1MEN1KMT2A
SCHEMBL440247 0.75 XDH (0.41) CDK2CNR2CCNA2CCNA1THRA

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 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4134364-B1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2025-07-30 EP disclosed
US-20240182490-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2024-06-06 US disclosed
US-11884680-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2024-01-30 US disclosed
EP-4134364-A2 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2023-02-15 EP disclosed
EP-4134364-A2 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2023-02-15 EP disclosed
US-20220315601-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2022-10-06 US disclosed
EP-3640241-B1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2022-09-28 EP disclosed
CN-108558889-B Bromodomain inhibitors 赛尔基因昆蒂赛尔研究公司 2021-11-05 CN disclosed
US-10941160-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2021-03-09 US disclosed
US-10941160-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2021-03-09 US disclosed
US-20150111885-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2015-04-23 US disclosed
WO-2015058160-A1 BROMODOMAIN INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2015-04-23 WO disclosed
EP-2627637-A1 N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES F. Hoffmann-La Roche AG (CH) 2013-08-21 EP disclosed
US-8410107-B2 N-pyridin-3-yl or N-pyrazin-2-yl carboxamides HOFFMANN-LA ROCHE INC. (US) 2013-04-02 US disclosed
US-8410107-B2 N-pyridin-3-yl or N-pyrazin-2-yl carboxamides HOFFMANN-LA ROCHE INC. (US) 2013-04-02 US disclosed
US-8410107-B2 N-pyridin-3-yl or N-pyrazin-2-yl carboxamides HOFFMANN-LA ROCHE INC. (US) 2013-04-02 US disclosed
US-20120094993-A1 N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2012-04-19 US disclosed
US-20120094993-A1 N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2012-04-19 US disclosed
US-20120094993-A1 N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2012-04-19 US disclosed
WO-2012049190-A1 N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2012-04-19 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 (6 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-20240182490-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 CDK2 324/4885CNR2 3909/4885CCNA2 821/4885
US-20220315601-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 CDK2 324/4885CNR2 3909/4885CCNA2 821/4885
US-20150111885-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 CDK2 324/4885CNR2 3909/4885CCNA2 821/4885
US-10941160-B2 Bromodomain inhibitors BRD3, EP300, BRPF3 CDK2 324/4885CNR2 3909/4885CCNA2 821/4885
US-20120094993-A1 N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES APOB, CETP, NPC1L1 CDK2 1475/4885CNR2 63/4885CCNA2 2827/4885
US-11884680-B2 Bromodomain inhibitors BRD3, EP300, BRPF3 CDK2 324/4885CNR2 3909/4885CCNA2 821/4885

“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.