SCHEMBL12117254

SCHEMBL12117254

CC1(C)c2ccccc2-c2cc3c(cc21)c1cc(N2c4ccccc4C(C)(C)c4ccccc42)ccc1n3-c1cccc2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ PGR P06401 2/20 0.32
▸ ELANE P08246 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GSK3A P49840 1/20 0.30
▸ GSK3B P49841 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
SCHEMBL12117232 0.96 MEN1 (0.34) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL12117274 0.93 MEN1 (0.33) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL17228839 0.88 MEN1 (0.40) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL14822247 0.86 KDM4E (0.35) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL17245829 0.85 MAPT (0.40) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL23862366 0.85 MEN1 (0.36) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL12117253 0.85 PGR (0.40) MEN1KMT2APGR
SCHEMBL17245721 0.83 MEN1 (0.40) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL19653591 0.83 KDM4E (0.32) MEN1MAPTKMT2AKDM4EMAPK1
SCHEMBL23862276 0.83 KDM4E (0.32) MEN1MAPTKMT2AKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10008673-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2018-06-26 — — US disclosed
US-20170155062-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-06-01 — — US disclosed
US-20170155062-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-06-01 — — US disclosed
US-9475792-B2 Materials for organic electroluminescence devices MERCK PATENT GMBH (DE) 2016-10-25 — — US disclosed
US-9475792-B2 Materials for organic electroluminescence devices MERCK PATENT GMBH (DE) 2016-10-25 — — US disclosed
US-20120319052-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-12-20 — — US disclosed
US-20120319052-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-12-20 — — US disclosed
US-20110272684-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2011-11-10 — — US disclosed
US-20110272684-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2011-11-10 — — US disclosed
WO-2011107186-A2 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-09-09 — — WO disclosed
WO-2010083872-A2 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-07-29 — — 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 (4 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-20170155062-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP1B1, CYP1A1, CYP2E1 MEN1 62/4885MAPT 2304/4885KMT2A 1564/4885
US-10008673-B2 Compounds for electronic devices CYP1B1, CYP1A1, CYP2E1 MEN1 62/4885MAPT 2304/4885KMT2A 1564/4885
US-20110272684-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES SLCO4C1, SLCO2A1, SLCO1A2 MEN1 2133/4885MAPT 2011/4885KMT2A 3818/4885
US-20120319052-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP1B1, CYP1A1, CYP2E1 MEN1 62/4885MAPT 2304/4885KMT2A 1564/4885

“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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