SCHEMBL10048314

SCHEMBL10048314

Cc1ccc2c(c1)C(C)(C)c1ccccc1C2=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.58
PGR P06401 2/20 0.46
PDK2 Q15119 2/20 0.46
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
THRB P10828 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL22797190 0.91 ELANE (0.52) ELANEPGRPDK2MAOAMAOB
SCHEMBL15281144 0.89 ELANE (0.58) ELANEPGRPDK2MAOAMAOB
SCHEMBL18463551 0.89 PDK2 (0.56) ELANEPGRPDK2TDP1ALDH1A1
SCHEMBL13191327 0.85 ELANE (0.62) ELANEPGRPDK2MAOAMAOB
SCHEMBL29522682 0.84 MEN1 (0.52) ELANEPGRPDK2MAOAMAOB
SCHEMBL12997894 0.84 MEN1 (0.52) ELANEPGRPDK2MAOAMAOB
SCHEMBL1855552 0.84 MEN1 (0.52) ELANEPGRPDK2MAOAMAOB
SCHEMBL12997896 0.84 MEN1 (0.52) ELANEPGRPDK2MAOAMAOB
SCHEMBL12685770 0.83 ELANE (0.55) ELANEPGRPDK2MAOAMAOB
SCHEMBL14702110 0.82 PDK2 (0.42) ELANEPGRPDK2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11917913-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2024-02-27 US disclosed
US-11917913-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2024-02-27 US disclosed
US-20220140249-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2022-05-05 US disclosed
US-20190280218-A1 SUBSTITUTED OXEPINES MERCK PATENT GMBH (DE) 2019-09-12 US disclosed
US-10374170-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2019-08-06 US disclosed
EP-2651862-B1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2017-05-10 EP disclosed
US-9598637-B2 Phosphorus-containing metal complexes MERCK PATENT GMBH (DE) 2017-03-21 US disclosed
US-9598637-B2 Phosphorus-containing metal complexes MERCK PATENT GMBH (DE) 2017-03-21 US disclosed
US-20160308146-A1 SUBSTITUTED OXEPINES MERCK PATENT GMBH (DE) 2016-10-20 US disclosed
US-20160308146-A1 SUBSTITUTED OXEPINES MERCK PATENT GMBH (DE) 2016-10-20 US disclosed
US-9029425-B2 Substituted dibenzo[FG,OP]tetracenes and formulations or electronic devices containing the same MERCK PATENT GMBH (DE) 2015-05-12 US disclosed
US-20150057445-A1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2015-02-26 US disclosed
US-20150057445-A1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2015-02-26 US disclosed
US-8906893-B2 Substituted tetraarylbenzenes MERCK PATENT GMBH (DE) 2014-12-09 US disclosed
US-8906893-B2 Substituted tetraarylbenzenes MERCK PATENT GMBH (DE) 2014-12-09 US disclosed
US-20130261708-A1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2013-10-03 US disclosed
US-20130261708-A1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2013-10-03 US disclosed
US-20130253617-A1 PHOSPHORUS-CONTAINING METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-09-26 US disclosed
US-20130253617-A1 PHOSPHORUS-CONTAINING METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-09-26 US disclosed
WO-2012038029-A1 PHOSPHORUS-CONTAINING METAL COMPLEXES MERCK PATENT GMBH (DE) 2012-03-29 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 (5 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-20220140249-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CDYL, MRPL38, CDYL2 ELANE 2036/4885PGR 1867/4885PDK2 3992/4885
US-11917913-B2 Substituted oxepines OXGR1, OXTR, OCIAD2 ELANE 1010/4885PGR 1812/4885PDK2 741/4885
US-10374170-B2 Substituted oxepines OXGR1, OXTR, OCIAD2 ELANE 1010/4885PGR 1812/4885PDK2 741/4885
US-20190280218-A1 SUBSTITUTED OXEPINES OXGR1, OXTR, OCIAD2 ELANE 1010/4885PGR 1812/4885PDK2 741/4885
US-20160308146-A1 SUBSTITUTED OXEPINES OXGR1, OXTR, OCIAD2 ELANE 1010/4885PGR 1812/4885PDK2 741/4885

“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.