SCHEMBL10052687

SCHEMBL10052687

Cn1c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2c2cc3c(cc21)C(C)(C)c1ccccc1-3

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ PTGER4 P35408 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ RXRA P19793 1/20 0.32
▸ RXRB P28702 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ HSD11B1 P28845 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ CHEK1 O14757 1/20 0.31
▸ WEE1 P30291 1/20 0.31
▸ SLC2A1 P11166 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.30
▸ ADORA3 P0DMS8 1/20 0.30

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
SCHEMBL20687298 0.89 RXRA (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL802490 0.87 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL802740 0.86 ALDH1A1 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL783561 0.86 ALDH1A1 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL783126 0.85 RXRA (0.32) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL802738 0.85 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL783165 0.84 MEN1 (0.32) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL782089 0.84 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL802996 0.84 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL802706 0.84 MEN1 (0.31) MEN1KMT2AMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10374170-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2019-08-06 — — US disclosed
EP-2673249-B1 SUBSTITUTED DIBENZONAPHTHACENE MERCK PATENT GMBH (DE) 2019-04-03 — — EP disclosed
EP-2651862-B1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2017-05-10 — — EP 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-9231220-B2 Substituted tetraarylbenzenes MERCK PATENT GMBH (DE) 2016-01-05 — — US disclosed
US-9231220-B2 Substituted tetraarylbenzenes MERCK PATENT GMBH (DE) 2016-01-05 — — 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-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
WO-2012079678-A1 SUBSTITUTED TETRAARYLBENZENES MERCK PATENT GMBH (DE) 2012-06-21 — — 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 (2 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-10374170-B2 Substituted oxepines OXGR1, OXTR, OCIAD2 MEN1 2568/4885KMT2A 1267/4885MAPT 1547/4885
US-20160308146-A1 SUBSTITUTED OXEPINES OXGR1, OXTR, OCIAD2 MEN1 2568/4885KMT2A 1267/4885MAPT 1547/4885

“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.

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