SCHEMBL2495006

SCHEMBL2495006

C=C(C)c1cccc([Si](CC)(OC(C)(C)C)c2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
ALPL P05186 1/20 0.34
GLA P06280 1/20 0.34
ALPI P09923 1/20 0.34
ALPG P10696 1/20 0.34
KMT2A Q03164 3/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
SLC7A5 Q01650 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 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
SCHEMBL2497372 0.87 TSHR (0.31) TSHR
SCHEMBL2500418 0.83 TSHR (0.35) ALDH1A1MAPTKDM4ESMN1; SMN2ALPL
SCHEMBL706547 0.81 MAPK1 (0.32) ALDH1A1
SCHEMBL2502277 0.80 TSHR (0.35) ALDH1A1MAPTKDM4ESMN1; SMN2ALPL
SCHEMBL2500388 0.78 SMN1; SMN2 (0.34) ALDH1A1MAPTKDM4ESMN1; SMN2ALPL
SCHEMBL2504327 0.77 TP53 (0.37) ALDH1A1TSHR
SCHEMBL2502516 0.76 TSHR (0.33) ALDH1A1MAPTKDM4ESMN1; SMN2ALPL
SCHEMBL2501155 0.72 PAX8 (0.33) ALDH1A1TSHR
SCHEMBL2497634 0.71 ALDH1A1 (0.38) ALDH1A1TSHR
SCHEMBL28935402 0.70 MEN1 (0.38) ALDH1A1KMT2ATSHRMEN1

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
US-8497334-B2 Conjugated diene polymer, conjugated diene polymer composition, and method for producing conjugated diene polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-30 US disclosed
US-20110245407-A1 CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 US disclosed