SCHEMBL11032155

SCHEMBL11032155

O=C(O[C@@H]1[C@@H](OC(=O)c2ccccc2)[C@@H](O[C@]2(CO)O[C@H](CO)[C@@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)O[C@H](CO)[C@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.51
▸ LGALS3 P17931 4/20 0.44
▸ LGALS9 O00182 3/20 0.44
▸ LGALS1 P09382 3/20 0.44
▸ LGALS7; LGALS7B P47929 3/20 0.44
▸ SELP P16109 7/20 0.39
▸ LGALS4 P56470 1/20 0.38
▸ SELE P16581 1/20 0.38
▸ PTPN1 P18031 1/20 0.36
▸ MAOB P27338 1/20 0.35
▸ LGALS8 O00214 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ABCB1 P08183 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
SCHEMBL21768322 0.91 EPHX2 (0.43) EPHX2LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL9259140 0.83 EPHX2 (0.59) EPHX2LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL343136 0.81 MAPT (0.49) PTPN1MAPT
SCHEMBL10310560 0.81 MAPT (0.49) PTPN1MAPT
SCHEMBL14906687 0.81 MAPT (0.49) PTPN1MAPT
SCHEMBL10310585 0.81 MAPT (0.49) PTPN1MAPT
SCHEMBL14903566 0.81 MAPT (0.49) PTPN1MAPT
SCHEMBL2506760 0.80 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BSELP
SCHEMBL2508264 0.80 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BSELP
SCHEMBL14530940 0.80 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BSELP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4447571-A WITH ALKYL AMINES AND HYDRAZIDES; DISCOLORATION INHIBITION WITCO CHEMICAL CORPORATION (US) 1984-05-08 — — US disclosed
US-4147679-A CHAIN EXTENDING ISOCYANATE AND ANIONIC SALT CONTAINING POLYMER PPG INDUSTRIES, INC. (US) 1979-04-03 — — US disclosed
US-4066591-A DISPERSION, CHAIN EXTENSION PPG INDUSTRIES, INC. (US) 1978-01-03 — — US disclosed
US-4046729-A THERMOSETTING PPG INDUSTRIES, INC. (US) 1977-09-06 — — US disclosed
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