SCHEMBL8577949

SCHEMBL8577949

CCCCCCCCCCCCOC[C@H]1O[C@H](OCCCCCCCCCCCC)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.47
PTPN2 P17706 2/20 0.44
PTPN6 P29350 2/20 0.44
PTPN11 Q06124 2/20 0.44
SSTR1 P30872 1/20 0.41
SSTR2 P30874 1/20 0.41
SSTR4 P31391 1/20 0.41
SSTR3 P32745 1/20 0.41
SSTR5 P35346 1/20 0.41
GJB2 P29033 3/20 0.41
NT5E P21589 1/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TACR1 P25103 1/20 0.40
TNF P01375 1/20 0.39

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
SCHEMBL8573455 1.00 PTPN1 (0.47) PTPN1PTPN2PTPN6PTPN11SSTR1
SCHEMBL8576622 1.00 PTPN1 (0.47) PTPN1PTPN2PTPN6PTPN11SSTR1
SCHEMBL15833434 0.92 PTPN1 (0.48) PTPN1PTPN2PTPN11TSHRALDH1A1
SCHEMBL16299427 0.92 PTPN1 (0.48) PTPN1PTPN2PTPN11TSHRALDH1A1
SCHEMBL17850338 0.90 PTPN1 (0.49) PTPN1PTPN2PTPN11TSHRLMNA
SCHEMBL26822757 0.90 PTPN1 (0.49) PTPN1PTPN2PTPN11TSHRLMNA
SCHEMBL8576619 0.89 LGALS9 (0.46) PTPN1TSHRALDH1A1LMNA
SCHEMBL8577941 0.89 LGALS9 (0.46) PTPN1TSHRALDH1A1LMNA
SCHEMBL8576095 0.89 LGALS9 (0.46) PTPN1TSHRALDH1A1LMNA
SCHEMBL8573452 0.89 LGALS9 (0.46) PTPN1TSHRALDH1A1LMNA

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