SCHEMBL11534628

SCHEMBL11534628

C[Si](C)(c1ccc(N)c(N)c1)c1ccc(N)c(N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.46
TDP1 Q9NUW8 5/20 0.46
ALOX15 P16050 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TP53 P04637 1/20 0.46
THRB P10828 1/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 5/20 0.40
TSHR P16473 3/20 0.40
NR4A1 P22736 1/20 0.39
PTK2 Q05397 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
CACNA1B Q00975 1/20 0.32

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
SCHEMBL6852410 0.78 ALDH1A1 (0.52) TDP1ALOX15SMN1; SMN2THRBMEN1
SCHEMBL6853490 0.78 ALOX15 (0.50) CYP3A4TDP1ALOX15SMN1; SMN2THRB
SCHEMBL3929512 0.78 CYP3A4 (0.50) CYP3A4TDP1ALOX15SMN1; SMN2TP53
SCHEMBL4527953 0.74 MEN1 (0.43) CYP3A4TDP1ALOX15SMN1; SMN2TP53
SCHEMBL28755799 0.73 CYP3A4 (0.41) CYP3A4TDP1ALOX15SMN1; SMN2TP53
SCHEMBL3923695 0.69 MEN1 (0.50) CYP3A4TDP1ALOX15SMN1; SMN2TP53
SCHEMBL65963 0.69 MEN1 (0.50) CYP3A4TDP1ALOX15SMN1; SMN2TP53
SCHEMBL6422988 0.67 CYP3A4 (0.52) CYP3A4TDP1ALOX15TP53MEN1
SCHEMBL29437105 0.67 CYP3A4 (0.52) CYP3A4TDP1ALOX15TP53MEN1
SCHEMBL21183074 0.65 ACHE (0.32) CYP3A4TDP1ALOX15SMN1; SMN2TP53

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-4045414-A New di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-08-30 US claimed
US-4147728-A Disubstituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1979-04-03 US disclosed
US-4064176-A Di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-12-20 US disclosed
US-4045414-A New di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-08-30 US disclosed