SCHEMBL8575225

SCHEMBL8575225

CCCCCCCCCCCCCCCCCCO[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 10/20 0.41
▸ PTPN2 P17706 2/20 0.39
▸ PTPN6 P29350 2/20 0.39
▸ PTPN11 Q06124 2/20 0.39
▸ CTSK P43235 1/20 0.37
▸ TNF P01375 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NT5E P21589 1/20 0.36
▸ ANTXR2 P58335 2/20 0.35
▸ TMPRSS2 O15393 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ PDE5A O76074 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ HMGCR P04035 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ FYN P06241 1/20 0.35

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
SCHEMBL8576383 1.00 PTPN1 (0.41) PTPN1PTPN2PTPN6PTPN11CTSK
SCHEMBL8577933 1.00 PTPN1 (0.41) PTPN1PTPN2PTPN6PTPN11CTSK
SCHEMBL8577792 1.00 PTPN1 (0.41) PTPN1PTPN2PTPN6PTPN11CTSK
SCHEMBL9702258 0.88 PTPN1 (0.39) PTPN1PTPN2PTPN6PTPN11TNF
SCHEMBL8577949 0.87 PTPN1 (0.47) PTPN1PTPN2PTPN6PTPN11TNF
SCHEMBL15833434 0.87 PTPN1 (0.48) PTPN1PTPN2PTPN11TNFTSHR
SCHEMBL8576622 0.87 PTPN1 (0.47) PTPN1PTPN2PTPN6PTPN11TNF
SCHEMBL16299427 0.87 PTPN1 (0.48) PTPN1PTPN2PTPN11TNFTSHR
SCHEMBL8573455 0.87 PTPN1 (0.47) PTPN1PTPN2PTPN6PTPN11TNF
SCHEMBL17850338 0.86 PTPN1 (0.49) PTPN1PTPN2PTPN11TNFTSHR

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
WO-1998016537-A1 NOVEL COMPOUNDS ASTRA AKTIEBOLAG (PUBL) (SE) 1998-04-23 — — WO disclosed
Send feedback