SCHEMBL18538270

SCHEMBL18538270

Cc1cc2c(O)c(c1)Cc1cc(CCc3ccccc3)cc(c1OCC(N)=O)Cc1cc(C)cc(c1O)Cc1cc(CCc3ccccc3)cc(c1O)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN2 P17706 2/20 0.40
▸ PTPN1 P18031 2/20 0.40
▸ PTPN11 Q06124 2/20 0.40
▸ PTPN4 P29074 1/20 0.40
▸ PTPN9 P43378 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ ALOX5 P09917 2/20 0.39
▸ CD69 Q07108 2/20 0.39
▸ ELANE P08246 1/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ TDP1 Q9NUW8 3/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36

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
SCHEMBL18538267 0.91 CD69 (0.50) PTPN2PTPN1PTPN11PTPN4PTPN9
SCHEMBL18538281 0.86 CD69 (0.40) PTPN2PTPN1PTPN11HTTCD69
SCHEMBL18538274 0.86 CD69 (0.40) PTPN2PTPN1PTPN11HTTCD69
SCHEMBL18538266 0.86 CD69 (0.40) PTPN2PTPN1PTPN11HTTCD69
SCHEMBL18538252 0.82 PTPN2 (0.50) PTPN2PTPN1PTPN11PTPN4PTPN9
SCHEMBL18538254 0.82 PTPN2 (0.50) PTPN2PTPN1PTPN11PTPN4PTPN9
SCHEMBL18538262 0.77 PTPN2 (0.40) PTPN2PTPN1PTPN11PTPN4PTPN9
SCHEMBL18538251 0.77 PTPN2 (0.40) PTPN2PTPN1PTPN11PTPN4PTPN9
SCHEMBL18538275 0.76 CD69 (0.52) PTPN2PTPN1CD69ELANEKDM4E
SCHEMBL18538268 0.76 CD69 (0.52) PTPN2PTPN1CD69ELANEKDM4E

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
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