SCHEMBL1937060

SCHEMBL1937060

COC(=O)Oc1cc(N)cs1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.33
KDM4E B2RXH2 4/20 0.33
HPGD P15428 3/20 0.33
GAA P10253 3/20 0.33
CUL4A Q13619 2/20 0.31
ALDH1A1 P00352 8/20 0.31
MAPT P10636 6/20 0.31
LMNA P02545 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
JAK2 O60674 1/20 0.31
HTT P42858 1/20 0.31
PRKCZ Q05513 1/20 0.31
MAPK1 P28482 2/20 0.31
TSHR P16473 1/20 0.30
GFER P55789 1/20 0.30
ALOX5 P09917 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
SCHEMBL6223306 0.79 CUL4A (0.41) HSD17B10KDM4EHPGDGAACUL4A
SCHEMBL17630210 0.79
SCHEMBL4454393 0.73
SCHEMBL17630170 0.70 ALDH1A1 (0.35) HSD17B10KDM4EHPGDGAACUL4A
SCHEMBL6223351 0.70 ALAD (0.50) KDM4EGAAALDH1A1MAPTSMN1; SMN2
SCHEMBL234370 0.69 CTPS1 (0.42) HSD17B10KDM4EHPGDGAAALDH1A1
SCHEMBL6594701 0.68 KDM4E (0.49) HSD17B10KDM4EHPGDGAAALDH1A1
SCHEMBL8777826 0.68 CYP19A1 (0.40) HSD17B10KDM4EHPGDGAAALDH1A1
SCHEMBL17630168 0.68 KDM4E (0.37) HSD17B10KDM4EHPGDGAACUL4A
Bromide SCHEMBL17201605 0.68 CTPS1 (0.41) HSD17B10KDM4EHPGDGAAALDH1A1

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
EP-3197891-B1 FACTOR XIA-INHIBITING PYRIDOBENZAZEPINE AND PYRIDOBENZAZOCINE DERIVATIVES Bayer Pharma AG (DE) 2018-11-21 EP disclosed
EP-1910330-B1 HETEROCYCLYLAMIDE-SUBSTITUTED THIAZOLES, PYRROLES AND THIOPHENES AICURIS GMBH & CO KG (DE) 2014-07-23 EP disclosed
EP-2331532-A1 THIENYLAMINO PYRIMIDINES FOR USE AS FUNGICIDES Bayer CropScience AG (DE) 2011-06-15 EP disclosed
WO-2010025851-A1 THIENYLAMINO PYRIMIDINES FOR USE AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-03-11 WO disclosed
EP-1910330-A1 HETEROCYCLYLAMIDE-SUBSTITUTED THIAZOLES, PYRROLES AND THIOPHENES Bayer HealthCare AG (DE) 2008-04-16 EP disclosed
WO-2007009578-A1 HETEROCYCLYLAMIDE-SUBSTITUTED THIAZOLES, PYRROLES AND THIOPHENES BAYER HEALTHCARE AG (DE) 2007-01-25 WO disclosed