SCHEMBL13429512

SCHEMBL13429512

CCCCCCOc1ccc(C2(c3ccc(OCCCCCC)c(C(=O)O)c3)c3cc(Br)ccc3-c3ccc(B4Oc5ccccc5O4)cc32)cc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 8/20 0.46
▸ S1PR3 Q99500 1/20 0.41
▸ PTPN1 P18031 2/20 0.39
▸ PTPN6 P29350 1/20 0.39
▸ CYSLTR2 Q9NS75 1/20 0.39
▸ CYSLTR1 Q9Y271 1/20 0.39
▸ MEN1 O00255 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ ADRA2A P08913 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 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
SCHEMBL13429528 0.88 PTPN11 (0.43) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13429582 0.82 PTPN11 (0.48) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13429832 0.82 PTPN11 (0.48) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13429633 0.78 PTPN11 (0.45) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13430038 0.78 PTPN11 (0.46) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL812044 0.78 PTPN11 (0.42) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL13400894 0.77 PTPN11 (0.53) PTPN11S1PR3PTPN1PTPN6MEN1
SCHEMBL13400902 0.77 PTPN11 (0.53) PTPN11S1PR3PTPN1PTPN6MEN1
SCHEMBL10299949 0.75 PTPN11 (0.40) PTPN11S1PR3PTPN1PTPN6CYSLTR2
SCHEMBL12634945 0.75 SMN1; SMN2 (0.41) PTPN11PTPN1CYSLTR2CYSLTR1MEN1

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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