SCHEMBL9149012

SCHEMBL9149012

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 2/20 0.45
LGALS9 O00182 1/20 0.45
LGALS1 P09382 1/20 0.45
LGALS7; LGALS7B P47929 1/20 0.45
PTPN1 P18031 6/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 3/20 0.42
HTT P42858 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN11 Q06124 1/20 0.42
LGALS4 P56470 1/20 0.40
SYNJ2 O15056 3/20 0.40
SELP P16109 2/20 0.40
MAOB P27338 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 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
SCHEMBL18880344 0.95 LGALS9 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18880339 0.95 LGALS9 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL10521857 0.91 PTPN1 (0.51) PTPN1MEN1USP2POLBKMT2A
SCHEMBL10521846 0.91 PTPN1 (0.51) PTPN1MEN1USP2POLBKMT2A
SCHEMBL24192987 0.88 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL9313546 0.88 MAOB (0.51) ALDH1A1HTTSYNJ2MAOBCA1
SCHEMBL9313559 0.88 MAOB (0.51) ALDH1A1HTTSYNJ2MAOBCA1
SCHEMBL25084374 0.86 PTPN1 (0.57) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL20990764 0.86 PTPN1 (0.57) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL11896842 0.86 PTPN1 (0.57) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5474986-A Galabiose derivatives modified at 3* and anomeric positions SYMBICOM AKTIEBOLAG (SE) 1995-12-12 US disclosed
EP-0428605-B1 SYNTHETIC RECEPTOR ANALOGUES SYMBICOM AB (SE) 1994-10-19 EP disclosed