SCHEMBL23707392

SCHEMBL23707392

Nc1ccc(CNC=O)cc1C#CC1CCOCC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.33
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH7 P40394 1/20 0.32
RET P07949 1/20 0.31

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
SCHEMBL23704112 0.71 MAPK1 (0.36) RET
SCHEMBL23655389 0.67 ADH1B (0.46) ADH1BADH1CADH1AADH7
SCHEMBL21901271 0.63 PGK1 (0.34) PTPN11
SCHEMBL25544263 0.62 SRC (0.33)
SCHEMBL3228789 0.61 PTPN11 (0.49) PTPN11
SCHEMBL17469092 0.60 ALDH1A1 (0.51) ADH1BADH1CADH1AADH7
SCHEMBL22768050 0.60 PTPN11 (0.33) PTPN11
SCHEMBL1465043 0.60 TDP1 (0.46) PTPN11
SCHEMBL8763196 0.60 ADH1B (0.76) ADH1BADH1CADH1AADH7
SCHEMBL43651 0.59 ADH1B (0.61) ADH1BADH1CADH1AADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021154902-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF ANIMA BIOTECH INC. (US) 2021-08-05 WO disclosed