SCHEMBL196237

SCHEMBL196237

Oc1c(-c2nc3ccccc3o2)ccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM6B O15054 1/20 0.54
KDM6A O15550 1/20 0.54
ESR1 P03372 8/20 0.54
ESR2 Q92731 8/20 0.54
ALDH1A1 P00352 5/20 0.53
HPGD P15428 5/20 0.53
MAPT P10636 4/20 0.53
HSD17B10 Q99714 4/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
TP53 P04637 3/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
PKM P14618 2/20 0.53
HCRTR1 O43613 1/20 0.53
KDM4E B2RXH2 3/20 0.52
USP2 O75604 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TOP2A P11388 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50

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
SCHEMBL196215 0.83 KDM4E (0.56) ESR1ESR2ALDH1A1HPGDMAPT
SCHEMBL18086820 0.83 RPS6KA3 (0.57) ESR1ESR2ALDH1A1HPGDMAPT
SCHEMBL29627559 0.83 ALDH1A1 (0.65) KDM6BKDM6AESR1ESR2ALDH1A1
SCHEMBL30682 0.83 ALDH1A1 (0.65) KDM6BKDM6AESR1ESR2ALDH1A1
SCHEMBL30096340 0.83 ALDH1A1 (0.65) KDM6BKDM6AESR1ESR2ALDH1A1
SCHEMBL1200247 0.83 ALDH1A1 (0.54) KDM6BKDM6AESR1ESR2ALDH1A1
SCHEMBL18086821 0.81 ESR1 (0.51) ESR1ESR2ALDH1A1HPGDMAPT
SCHEMBL987895 0.80 ALDH1A1 (0.68) KDM6BKDM6AESR1ESR2ALDH1A1
SCHEMBL29531231 0.80 ALDH1A1 (0.68) KDM6BKDM6AESR1ESR2ALDH1A1
SCHEMBL9292938 0.79 KDM6B (0.55) KDM6BKDM6AESR1ESR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9221770-B2 Compounds having electron transport properties, their preparation and use MERCK PATENT GMBH (DE) 2015-12-29 US claimed
JP-2012500235-A 2012-01-05 JP claimed
US-20110108819-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE MERCK PATENT GMBH (DE) 2011-05-12 US claimed
EP-2313383-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE Merck Patent GmbH (DE) 2011-04-27 EP claimed
WO-2010020352-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE MERCK PATENT GMBH (DE) 2010-02-25 WO claimed
US-11723268-B2 Organic light-emitting element LG CHEM, LTD. 2023-08-08 US disclosed
US-20180175302-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2018-06-21 US disclosed
US-20180130955-A1 ORGANIC COMPOUND, MIXTURE COMPRISING SAME, COMPOSITE, AND ORGANIC ELECTRONIC COMPONENT GUANGZHOU CHINARAY OPTOELECTRONICS MATERIALS LTD. (CN) 2018-05-10 US disclosed
US-20180130961-A1 ORGANIC METAL COMPLEX, AND POLYMER, MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE CONTAINING SAME AND USE THEREOF GUANGZHOU CHINARAY OPTOELECTRONICS MATERIALS LTD. (CN) 2018-05-10 US disclosed
US-20180130853-A1 DISPLAY COMPONENT AND MANUFACTURING METHOD THEREFOR GUANGZHOU CHINARAY OPTOELECTRONICS MATERIALS LTD. (CN) 2018-05-10 US disclosed
US-20180022865-A1 CONJUGATED POLYMER CONTAINING ETHYNYL CROSSLINKING GROUP, MIXTURE COMPOSITION, ORGANIC ELECTRONIC DEVICE CONTINAING THE SAME AND APPLICATION THEROF GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2018-01-25 US disclosed
US-20170365789-A1 COMPOUND, MIXTURE COMPRISING THE SAME, COMPOSITION AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2017-12-21 US disclosed
US-20120097899-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-04-26 US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 US disclosed
US-20110108819-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE MERCK PATENT GMBH (DE) 2011-05-12 US disclosed
US-20110095282-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING TRIAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2011-04-28 US disclosed
US-20110095282-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING TRIAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2011-04-28 US disclosed
EP-2313383-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE Merck Patent GmbH (DE) 2011-04-27 EP disclosed
WO-2011047390-A2 HETEROCYCLIC BENZOXAZOLE COMPOSITIONS AS INHIBITORS OF HEPATITIS C VIRUS UNIVERSITY OF MARYLAND, BALTIMORE COUNTY (US) 2011-04-21 WO disclosed
WO-2010020352-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE MERCK PATENT GMBH (DE) 2010-02-25 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 (9 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-20180130955-A1 ORGANIC COMPOUND, MIXTURE COMPRISING SAME, COMPOSITE, AND ORGANIC ELECTRONIC COMPONENT OCIAD1, OCIAD2, SRD5A1 KDM6B 3683/4885KDM6A 3843/4885ESR1 48/4885
US-20180175302-A1 ORGANIC LIGHT-EMITTING DEVICE CRY1, CRY2, NR2E3 KDM6B 965/4885KDM6A 1437/4885ESR1 18/4885
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 KDM6B 1660/4885KDM6A 2531/4885ESR1 626/4885
US-20120097899-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO4C1, ICMT, NUDC KDM6B 3580/4885KDM6A 2953/4885ESR1 1063/4885
US-20110095282-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING TRIAZINE DERIVATIVES KCNJ2, IKZF2, TERT KDM6B 2812/4885KDM6A 3070/4885ESR1 774/4885
US-20110108819-A1 COMPOUNDS HAVING ELECTRON TRANSPORT PROPERTIES, THEIR PREPARATION AND USE SLC25A21, SLCO4C1, SLCO1B3 KDM6B 4507/4885KDM6A 4462/4885ESR1 411/4885
US-20170365789-A1 COMPOUND, MIXTURE COMPRISING THE SAME, COMPOSITION AND ORGANIC ELECTRONIC DEVICE DDT, DRD3, ICMT KDM6B 1509/4885KDM6A 2029/4885ESR1 29/4885
US-11723268-B2 Organic light-emitting element CRY2, NR2E3, CRY1 KDM6B 1514/4885KDM6A 1655/4885ESR1 4/4885
US-20180130961-A1 ORGANIC METAL COMPLEX, AND POLYMER, MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE CONTAINING SAME AND USE THEREOF OCIAD1, OCIAD2, SEM1 KDM6B 2150/4885KDM6A 2233/4885ESR1 164/4885

“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.