SCHEMBL7399363

SCHEMBL7399363

c1nn2cnnc2c2c1C1CCC2CC1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
MAPT P10636 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
SCHEMBL10968126 0.70 HTT (0.47) KDM4EMAPT
SCHEMBL25153048 0.67 HTT (0.44) KDM4EMAPT
SCHEMBL10965228 0.65 HTT (0.45) KDM4EMAPT
SCHEMBL25153046 0.64 HTT (0.44) KDM4EMAPT
SCHEMBL25158727 0.60 FLT3 (0.36)
SCHEMBL3101449 0.59 TDO2 (0.38)
SCHEMBL22083942 0.59 KDM4E (0.38) KDM4E
SCHEMBL31197246 0.59 TDO2 (0.34)
SCHEMBL9920397 0.57 HTT (0.34) KDM4EMAPT
SCHEMBL9920402 0.56

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915877-A1 SUBSTITUTED TRIAZOLO PYRIDAZINE DERIVATIVES AS INVERSE AGONISTS OF THE GABA A?$g(a)5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LTD. (GB) 1999-05-19 EP claimed
WO-1998004560-A1 SUBSTITUTED TRIAZOLO PYRIDAZINE DERIVATIVES AS INVERSE AGONISTS OF THE GABAAα5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LIMITED (GB) 1998-02-05 WO claimed
US-11083732-B2 Use of negative modulators of GABA receptors containing alpha5 subunits as fast acting antidepressants UNIVERSITY OF MARYLAND, BALTIMORE (US) 2021-08-10 US disclosed
EP-3125902-B1 USE OF NEGATIVE MODULATORS OF GABA RECEPTORS CONTAINING ALPHA5 SUBUNITS AS FAST ACTING ANTIDEPRESSANTS UNIV MARYLAND (US) 2020-09-16 EP disclosed
EP-3125902-A2 USE OF NEGATIVE MODULATORS OF GABA RECEPTORS CONTAINING ALPHA5 SUBUNITS AS FAST ACTING ANTIDEPRESSANTS University of Maryland, Baltimore (US) 2017-02-08 EP disclosed
US-20170020892-A1 USE OF NEGATIVE MODULATORS OF GABA RECEPTORS CONTAINING ALPHA5 SUBUNITS AS FAST ACTING ANTIDEPRESSANTS UNIVERSITY OF MARYLAND, BALTIMORE (US) 2017-01-26 US disclosed
WO-2015153658-A2 USE OF NEGATIVE MODULATORS OF GABA RECEPTORS CONTAINING ALPHA5 SUBUNITS AS FAST ACTING ANTIDEPRESSANTS UNIVERSITY OF MARYLAND, BALTIMORE (US) 2015-10-08 WO disclosed
EP-0915877-A1 SUBSTITUTED TRIAZOLO PYRIDAZINE DERIVATIVES AS INVERSE AGONISTS OF THE GABA A?$g(a)5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LTD. (GB) 1999-05-19 EP disclosed
WO-1998004560-A1 SUBSTITUTED TRIAZOLO PYRIDAZINE DERIVATIVES AS INVERSE AGONISTS OF THE GABAAα5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LIMITED (GB) 1998-02-05 WO disclosed