SCHEMBL18538266

SCHEMBL18538266

Cc1cc2c(O)c(c1)Cc1cc(C)cc(c1O)Cc1cc(-c3ccccc3)cc(c1OCC(N)=O)Cc1cc(C)cc(c1O)C2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CD69 Q07108 2/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ELANE P08246 1/20 0.39
▸ GSTA1 P08263 6/20 0.39
▸ GSTP1 P09211 6/20 0.39
▸ LTB4R Q15722 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ PSMD14 O00487 1/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ PTPN1 P18031 3/20 0.37
▸ ACLY P53396 1/20 0.36
▸ PTPRC P08575 2/20 0.36
▸ PTPN2 P17706 2/20 0.36
▸ PTPRB P23467 2/20 0.36
▸ PTPN11 Q06124 2/20 0.36
▸ HTT P42858 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
SCHEMBL18538274 1.00 CD69 (0.40) CD69KMT2AHSD17B10ELANEGSTA1
SCHEMBL18538281 1.00 CD69 (0.40) CD69KMT2AHSD17B10ELANEGSTA1
SCHEMBL18538275 0.90 CD69 (0.52) CD69ELANEGSTA1GSTP1LTB4R
SCHEMBL18538272 0.90 CD69 (0.52) CD69ELANEGSTA1GSTP1LTB4R
SCHEMBL18538268 0.90 CD69 (0.52) CD69ELANEGSTA1GSTP1LTB4R
SCHEMBL18538270 0.86 PTPN2 (0.40) CD69KMT2AELANEGSTA1GSTP1
SCHEMBL18538277 0.82 ING2 (0.45) CD69ELANEGSTA1GSTP1PTPN1
SCHEMBL18538255 0.80 CRHBP (0.44) CD69KDM4EPTPN1PTPN2PTPN11
SCHEMBL18538253 0.80 CRHBP (0.44) CD69KDM4EPTPN1PTPN2PTPN11
SCHEMBL18538259 0.80 CRHBP (0.44) CD69KDM4EPTPN1PTPN2PTPN11

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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