SCHEMBL28291474

SCHEMBL28291474

CC[Si](CC)(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
CALM1 P0DP23 1/20 0.41
TSHR P16473 5/20 0.39
ALDH1A1 P00352 4/20 0.39
IDO1 P14902 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38
TRPA1 O75762 1/20 0.38
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
MAOB P27338 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
MAOA P21397 1/20 0.36
SLC6A2 P23975 1/20 0.36

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
SCHEMBL988373 0.95 TP53 (0.50) TP53CALM1TSHRALDH1A1IDO1
SCHEMBL9075987 0.86 LOXL2 (0.42) TP53CALM1LOXL2CYP3A4TAAR1
SCHEMBL1728429 0.83 CALM1 (0.50) TP53CALM1TSHRALDH1A1IDO1
SCHEMBL11146025 0.83 TP53 (0.39) TP53HPGDSIGMAR1
SCHEMBL9346229 0.83 ALDH1A1 (0.43) TP53TSHRALDH1A1KDM4ETDP1
SCHEMBL27943101 0.80 TP53 (0.46) TP53CALM1TSHRALDH1A1IDO1
SCHEMBL9350313 0.78 ALDH1A1 (0.43) TP53TSHRALDH1A1KDM4ETDP1
SCHEMBL14838179 0.77 TP53 (0.48) TP53CALM1TSHRALDH1A1IDO1
SCHEMBL8616446 0.77 TP53 (0.48) TP53CALM1TSHRALDH1A1IDO1
SCHEMBL13131224 0.77 TP53 (0.33) TP53

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
WO-2022054912-A1 RESIN COMPOSITION, CURED PRODUCT AND MANUFACTURING METHOD THEREFOR, AND LAMINATE 三菱ケミカル株式会社 2022-03-17 WO disclosed
CN-109641482-A The preparation of the cis- -1,4- polydiene of multiple silane functionals with the Si―H addition reaction in situ preparation by polymer glue 株式会社普利司通 2019-04-16 CN disclosed