SCHEMBL7435397

SCHEMBL7435397

Nc1cc(Cl)ccc1-n1cncn1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
POLB P06746 1/20 0.42

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
SCHEMBL29758077 1.00 KDM4E (0.50) KDM4ECRHBPCRHR2KMT2AMEN1
SCHEMBL17295794 0.79 CRHBP (0.47) KDM4ECRHBPCRHR2KMT2AMEN1
SCHEMBL17242393 0.79 APOBEC3A (0.50) CRHBPCRHR2KMT2AMEN1APOBEC3A
SCHEMBL31258656 0.79 CRHBP (0.47) KDM4ECRHBPCRHR2KMT2AMEN1
SCHEMBL1197438 0.79 CRHBP (0.44) KDM4ECRHBPCRHR2KMT2AMEN1
SCHEMBL994065 0.76 ALDH1A1 (0.46) KDM4ECRHBPCRHR2KMT2AMEN1
SCHEMBL17232477 0.76 L3MBTL1 (0.50) CRHBPCRHR2KMT2AMEN1APOBEC3A
SCHEMBL5475832 0.76 S1PR3 (0.45) KDM4ECRHBPCRHR2KMT2AMEN1
SCHEMBL21004956 0.76 APOBEC3A (0.44) CRHBPCRHR2KMT2AMEN1APOBEC3A
SCHEMBL616961 0.76 CRHBP (0.47) KDM4ECRHBPCRHR2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021110076-A1 OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE 深圳信立泰药业股份有限公司 2021-06-10 WO disclosed
WO-2021110076-A1 OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE 深圳信立泰药业股份有限公司 2021-06-10 WO disclosed
US-10240084-B2 Non-crystallizable pi-conjugated molecular glass mixtures, charge transporting molecular glass mixtures, luminescent molecular glass mixtures, or combinations thereof for organic light emitting diodes and other organic electronics and photonics applications MOLECULAR GLASSES, INC. (US) 2019-03-26 US disclosed
US-20150275076-A1 Non-crystallizable Pi-conjugated Molecular Glass Mixtures, Charge Transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications Molaire Consulting 2015-10-01 US disclosed
US-20150275076-A1 Non-crystallizable Pi-conjugated Molecular Glass Mixtures, Charge Transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications Molaire Consulting 2015-10-01 US disclosed
WO-2002064211-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2002-08-22 WO disclosed