SCHEMBL13429528

SCHEMBL13429528

CCCCCCOc1ccc(C2(c3ccc(OCCCCCC)c(C(=O)O)c3)c3cc(Br)ccc3-c3ccc(B4OC(C)(C)C(C)(C)O4)cc32)cc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 7/20 0.43
▸ S1PR3 Q99500 1/20 0.42
▸ PTPN1 P18031 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ CYSLTR2 Q9NS75 1/20 0.40
▸ CYSLTR1 Q9Y271 1/20 0.40
▸ LPL P06858 5/20 0.36
▸ LIPG Q9Y5X9 5/20 0.36
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 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
SCHEMBL13429512 0.88 PTPN11 (0.46) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL991767 0.86 LPL (0.36) PTPN11S1PR3PTPN1PTPN6LPL
SCHEMBL13429582 0.84 PTPN11 (0.48) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13429832 0.84 PTPN11 (0.48) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL12924858 0.81 LPL (0.33) PTPN11S1PR3PTPN1PTPN6LPL
SCHEMBL12634982 0.80 LPL (0.41) PTPN11PTPN1CYSLTR2CYSLTR1LPL
SCHEMBL13429633 0.80 PTPN11 (0.45) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13430038 0.79 PTPN11 (0.46) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL812044 0.79 PTPN11 (0.42) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13400902 0.78 PTPN11 (0.53) PTPN11S1PR3PTPN1PTPN6ALDH1A1

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-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 — — US disclosed
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