SCHEMBL3631295

SCHEMBL3631295

CCCCOC(Cc1ccccc1)NC[Si](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LTA4H P09960 2/20 0.38
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35

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
SCHEMBL21243278 0.82 SIGMAR1 (0.42) SIGMAR1ALDH1A1HPGDMEN1KMT2A
SCHEMBL794607 0.79 SIGMAR1 (0.41) SIGMAR1TSHR
SCHEMBL3275777 0.74 LTA4H (0.46) SIGMAR1ALDH1A1HPGDMEN1KMT2A
SCHEMBL10512424 0.72 MEN1 (0.46) SIGMAR1ALDH1A1HPGDMEN1KMT2A
SCHEMBL8726699 0.70 EPHX1 (0.50) SIGMAR1LTA4H
SCHEMBL8072690 0.70 LTA4H (0.42) SIGMAR1ALDH1A1HPGDMEN1KMT2A
SCHEMBL7759621 0.70 CSNK1E (0.47) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL3270666 0.70 CSNK1E (0.46) SIGMAR1ALDH1A1HPGDLTA4HTSHR
SCHEMBL6636645 0.70 CSNK1E (0.44) SIGMAR1
SCHEMBL7924701 0.69 ALDH1A1 (0.41) SIGMAR1ALDH1A1HPGDLTA4HTSHR

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
EP-2148853-A1 INSECTICIDAL ARYL PYRROLIDINES BAYER CROPSCIENCE AG (DE) 2010-02-03 EP disclosed
WO-2008128711-A1 INSECTICIDAL ARYL PYRROLIDINES BAYER CROPSCIENCE AG (DE) 2008-10-30 WO disclosed