SCHEMBL5373833

SCHEMBL5373833

CCC(C)(C)O[Si](OC(C)(C)CC)(OC(C)(C)CC)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.33
MAPK1 P28482 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 1/20 0.31
TAAR1 Q96RJ0 2/20 0.30
ALOX15 P16050 1/20 0.30
SLC6A2 P23975 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 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
SCHEMBL5377036 0.83 RIPK1 (0.33) RIPK1MAPK1ALDH1A1TSHRTDP1
SCHEMBL15309958 0.82 ESR1 (0.36) RIPK1MAPK1ALDH1A1TSHRTDP1
SCHEMBL17391474 0.82 ESR1 (0.32) RIPK1MAPK1ALDH1A1TSHRTDP1
SCHEMBL12034355 0.79
SCHEMBL191229 0.78 MAPK1 (0.37) MAPK1ALDH1A1TSHRTDP1TAAR1
SCHEMBL17391480 0.77 ALDH1A1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL2504895 0.76
SCHEMBL2495913 0.76
SCHEMBL20925943 0.72
SCHEMBL10864047 0.72 MAPK1 (0.34) MAPK1ALDH1A1TSHRTDP1

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-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US claimed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US claimed
US-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US disclosed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US disclosed