SCHEMBL783228

SCHEMBL783228

COC(=O)c1ccccc1Nc1ccc2[nH]c3ccccc3c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ KDM4E B2RXH2 4/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ MTNR1A P48039 1/20 0.56
▸ MTNR1B P49286 1/20 0.56
▸ KIF11 P52732 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.51
▸ GABRP O00591 1/20 0.51
▸ GABRD O14764 1/20 0.51
▸ PDE5A O76074 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ GABRA1 P14867 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ GABRB1 P18505 1/20 0.51
▸ GABRG2 P18507 1/20 0.51
▸ GABRB3 P28472 1/20 0.51

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
SCHEMBL12324066 0.80 MPL (0.55) MAPTALOX15KDM4EKIF11ALDH1A1
SCHEMBL12073116 0.80 KDM4E (0.49) MAPTKDM4EKMT2AMTNR1AMTNR1B
SCHEMBL13224505 0.79 MAPT (0.89) MAPTALOX15KDM4EKMT2AALDH1A1
Terofenamate SCHEMBL14857455 0.78 METTL3 (0.58) MAPTKMT2ALMNACYP1A2CYP3A4
SCHEMBL21315867 0.77 MAPT (0.57) MAPTALOX15KDM4EKMT2AALDH1A1
SCHEMBL15133574 0.77 ALOX5 (0.51) MAPTALOX15KDM4EKMT2AKIF11
SCHEMBL7783735 0.76 KMT2A (0.54) MAPTKDM4EKMT2AMTNR1AMTNR1B
SCHEMBL802021 0.76 SLC6A3 (0.58) MAPTKDM4EKMT2AMTNR1AMTNR1B
SCHEMBL2787546 0.76 MAPT (0.56) MAPTALOX15KDM4EKMT2AALDH1A1
SCHEMBL71508 0.75 KIF11 (0.82) MAPTKDM4EKMT2AKIF11ALDH1A1

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-10351557-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2019-07-16 — — US disclosed
US-9537105-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-01-03 — — US disclosed
US-9537105-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-01-03 — — US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 — — US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 — — US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 — — US disclosed
US-20130092879-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2013-04-18 — — US disclosed
US-20130092879-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2013-04-18 — — US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 — — US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 — — US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 — — US disclosed
WO-2011157346-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-12-22 — — WO disclosed
WO-2010136109-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-02 — — 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-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 MAPT 1399/4885ALOX15 1502/4885KDM4E 1899/4885
US-10351557-B2 Compounds for electronic devices CYP1B1, CYP2C19, CYP1A1 MAPT 2358/4885ALOX15 1023/4885KDM4E 3173/4885
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 MAPT 1399/4885ALOX15 1502/4885KDM4E 1899/4885
US-20130092879-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP1B1, CYP2C19, CYP1A1 MAPT 2258/4885ALOX15 990/4885KDM4E 3178/4885

“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.

Send feedback