SCHEMBL19928533

SCHEMBL19928533

CC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](OCc1ccccc1)[C@H](OCc1ccccc1)[C@@H](COC[C@@H](OCc1ccccc1)[C@@H](O)[C@H](O)[C@@H](CO)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
CA1 P00915 1/20 0.31
CYP2C19 P33261 1/20 0.31
BTN3A1 O00481 1/20 0.30

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
SCHEMBL19928559 0.97 MAPT (0.33) MAPTCA1CYP2C19BTN3A1
SCHEMBL19928527 0.92 MAPT (0.32) MAPTCA1
SCHEMBL19928534 0.92 MAPT (0.36) MAPTCA1CYP2C19BTN3A1
SCHEMBL18591520 0.88 MAPT (0.35) MAPTCA1CYP2C19BTN3A1
SCHEMBL19928558 0.86 MAPT (0.35) MAPTCA1CYP2C19BTN3A1
SCHEMBL19928532 0.85 MAPT (0.37) MAPTCA1CYP2C19BTN3A1
SCHEMBL15892778 0.85 MAPT (0.37) MAPTCA1CYP2C19BTN3A1
SCHEMBL19928526 0.84 MAPT (0.36) MAPTCA1CYP2C19BTN3A1
SCHEMBL14747381 0.82 CA1 (0.41) MAPTCA1CYP2C19
SCHEMBL19928535 0.81

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-9907854-B2 Crosslinking reagents, macromolecules, therapeutic bioconjugates, and synthetic methods thereof CellMosaic, Inc. (US) 2018-03-06 US disclosed