SCHEMBL8563142

SCHEMBL8563142

CC[Si](CC)(CC)O[C@@H](C(=O)O)[C@@](NC=O)(OC(C)(C)C)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 13/20 0.34
EDNRA P25101 13/20 0.34
KMT2A Q03164 2/20 0.31
NR1I2 O75469 1/20 0.31
KCNE1 P15382 1/20 0.31
KCNQ1 P51787 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
KIF11 P52732 1/20 0.30
KCNN4 O15554 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 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
SCHEMBL3787397 0.80 SLC1A3 (0.40) KMT2ACYP2C19
SCHEMBL9187436 0.80 EDNRB (0.32) EDNRBEDNRAKMT2AMAPTKIF11
SCHEMBL8085861 0.77 KCNN4 (0.36) KMT2AMAPTKIF11KCNN4CYP2C19
SCHEMBL7624597 0.68 KIF11 (0.32) KIF11
SCHEMBL9261168 0.68 MAPT (0.34) EDNRBEDNRAKMT2AMAPTKIF11
SCHEMBL8571936 0.67 MEN1 (0.35) EDNRBEDNRAKMT2AMAPTKIF11
SCHEMBL8784381 0.66 KCNN4 (0.40) KMT2AMAPTKCNN4CYP2C19HIF1A
SCHEMBL3786557 0.65 CYP2C19 (0.47) KMT2APOLBMAPTKCNN4CYP2C19
SCHEMBL7706278 0.65 SMN1; SMN2 (0.36) EDNRBEDNRAKMT2APOLBKIF11
SCHEMBL8567588 0.65 ALDH1A1 (0.38) KMT2AMAPT

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-5728849-A ANTITUMOR AND ANTILEUKEMIC AGENTS RHONE-POULENC RORER S.A. (FR) 1998-03-17 US disclosed