SCHEMBL2236497

SCHEMBL2236497

C1=Cc2sccc2ON=C1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL29757278 0.65 KDM4E (0.36)
SCHEMBL6118600 0.62
SCHEMBL28658792 0.62 CA2 (0.42)
SCHEMBL1327389 0.59 CA12 (0.33)
SCHEMBL28664612 0.58 CA12 (0.46)
SCHEMBL3205912 0.58
SCHEMBL28650137 0.58 CA2 (0.42)
SCHEMBL28947348 0.58 CDC25B (0.41)
SCHEMBL28961176 0.55
SCHEMBL8797345 0.54

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130130263-A1 GAMETES SEPARATION METHODS, COMPOSITIONS AND USES THEREOF ASSISTANCE PUBLIQUE - HOPITAUX DE PARIS (FR) 2013-05-23 US claimed
EP-2539434-A1 GAMETES SEPARATION METHODS, COMPOSITIONS AND USES THEREOF Assistance Publique - Hôpitaux de Paris (FR) 2013-01-02 EP claimed
WO-2011104336-A1 GAMETES SEPARATION METHODS, COMPOSITIONS AND USES THEREOF ASSISTANCE PUBLIQUE - HÔPITAUX DE PARIS (FR) 2011-09-01 WO claimed
EP-2361967-A1 Gametes separation methods, compositions and uses thereof Assistance Publique - Hôpitaux de Paris (FR) 2011-08-31 EP claimed
US-20150011513-A1 ALKYNE-, AZIDE- AND TRIAZOLE-CONTAINING FLAVONOIDS AS MODULATORS FOR MULTIDRUG RESISTANCE IN CANCERS THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2015-01-08 US disclosed
US-8916549-B2 Thienooxazepine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-12-23 US disclosed
US-8916549-B2 Thienooxazepine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-12-23 US disclosed
EP-2463290-B1 THIENOOXAZEPINE DERIVATIVE TAKEDA PHARMACEUTICAL (JP) 2014-03-05 EP disclosed
US-20130130263-A1 GAMETES SEPARATION METHODS, COMPOSITIONS AND USES THEREOF ASSISTANCE PUBLIQUE - HOPITAUX DE PARIS (FR) 2013-05-23 US disclosed
EP-2539434-A1 GAMETES SEPARATION METHODS, COMPOSITIONS AND USES THEREOF Assistance Publique - Hôpitaux de Paris (FR) 2013-01-02 EP disclosed
US-20120196848-A1 THIENOOXAZEPINE DERIVATIVE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-08-02 US disclosed
EP-2463290-A1 THIENOOXAZEPINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2012-06-13 EP disclosed
WO-2011104336-A1 GAMETES SEPARATION METHODS, COMPOSITIONS AND USES THEREOF ASSISTANCE PUBLIQUE - HÔPITAUX DE PARIS (FR) 2011-09-01 WO disclosed
EP-2361967-A1 Gametes separation methods, compositions and uses thereof Assistance Publique - Hôpitaux de Paris (FR) 2011-08-31 EP disclosed