SCHEMBL18538262

SCHEMBL18538262

Cc1cc2c(O)c(c1)Cc1cc(C)cc(c1O)Cc1cc(CCc3ccccc3)cc(c1OS(=O)(=O)c1ccccc1)Cc1cc(C)cc(c1O)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN4 P29074 1/20 0.40
PTPN9 P43378 1/20 0.40
PTPN11 Q06124 1/20 0.40
ALOX5 P09917 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
F2 P00734 5/20 0.36
ALDH1A1 P00352 2/20 0.36
EPHX2 P34913 1/20 0.34
NR3C1 P04150 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALPL P05186 1/20 0.34
P2RX7 Q99572 1/20 0.34
ING2 Q9H160 2/20 0.33
MMP1 P03956 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33

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
SCHEMBL18538251 1.00 PTPN2 (0.40) PTPN2PTPN1PTPN4PTPN9PTPN11
SCHEMBL18538264 0.91 PTPN1 (0.37) PTPN2PTPN1PTPN4PTPN9PTPN11
SCHEMBL18538250 0.91 PTPN1 (0.37) PTPN2PTPN1PTPN4PTPN9PTPN11
SCHEMBL18538265 0.91 PTPN1 (0.37) PTPN2PTPN1PTPN4PTPN9PTPN11
SCHEMBL18538260 0.90 ING2 (0.40) F2ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL18538284 0.84 ING2 (0.53) L3MBTL1F2NPC1RAB9ASMN1; SMN2
SCHEMBL18538263 0.84 ING2 (0.36) F2NPC1RAB9ASMN1; SMN2ALPL
SCHEMBL18538261 0.84 ING2 (0.36) F2NPC1RAB9ASMN1; SMN2ALPL
SCHEMBL18538248 0.84 ING2 (0.36) F2NPC1RAB9ASMN1; SMN2ALPL
SCHEMBL18538315 0.84 ING2 (0.53) L3MBTL1F2NPC1RAB9ASMN1; SMN2

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
US-20170052154-A1 COMPOUNDS AND CONJUGATES FOR IDENTIFYING AND SEPARATING POST-TRANSLATIONALLY MODIFIED ANALYTES UVIC INDUSTRY PARTNERSHIPS INC. (CA) 2017-02-23 US disclosed