SCHEMBL28013645

SCHEMBL28013645

CCOC(=O)CNC=C=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 7/20 0.40
TRPA1 O75762 1/20 0.40
CYP2D6 P10635 1/20 0.39
PPID Q08752 1/20 0.36
CYP1A2 P05177 1/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 2/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL11509431 0.77
SCHEMBL295774 0.77
SCHEMBL11509433 0.77 GAA (0.54) GAAMGAMSIMGAM2SMN1; SMN2
SCHEMBL10676884 0.75
SCHEMBL12613989 0.75
SCHEMBL11241636 0.75 GAA (0.52) GAAMGAMSIMGAM2SMN1; SMN2
SCHEMBL12532310 0.73 GAA (0.50) GAAMGAMSIMGAM2SMN1; SMN2
SCHEMBL295772 0.72
SCHEMBL8562716 0.72 SMN1; SMN2 (0.48) GAAMGAMSIMGAM2SMN1; SMN2
Malonic Acid Diethyl Ester SCHEMBL28885391 0.72 GAA (0.75) GAAMGAMSIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102947290-B Sulfonamido derivatives of 3, 4-diaryl pyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2015-05-27 CN claimed
CN-104958294-A Sulfonamido derivatives of 3, 4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2015-10-07 CN disclosed
CN-102947290-B Sulfonamido derivatives of 3, 4-diaryl pyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2015-05-27 CN disclosed