SCHEMBL17815438

SCHEMBL17815438

C=C(c1ccc([Si](CC)(CC)CC)cc1)c1cccc(C(=C)c2ccc([Si](CC)(CC)CC)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
CYP1A2 P05177 1/20 0.37
HSD17B14 Q9BPX1 1/20 0.34
KDM4E B2RXH2 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ACMSD Q8TDX5 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TRPV3 Q8NET8 2/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
ESR1 P03372 1/20 0.31
MAPT P10636 2/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
GFER P55789 1/20 0.30
HSD17B10 Q99714 1/20 0.30
GPR55 Q9Y2T6 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
SCHEMBL17811501 0.92 NR1H2 (0.37) NR1H2NR1H3CYP1A2HSD17B14
SCHEMBL17811492 0.81 HSD17B14 (0.35) NR1H2NR1H3CYP1A2HSD17B14KDM4E
SCHEMBL17815471 0.76 SLC6A4 (0.38) CYP1A2HSD17B14KDM4EALOX15TSHR
SCHEMBL20306694 0.76 ALDH1A1 (0.43) KDM4ETSHRTDP1KMT2AMEN1
SCHEMBL17811496 0.74
SCHEMBL17811495 0.73 NR1H2 (0.38) NR1H2NR1H3KMT2AMEN1MAPT
SCHEMBL17811472 0.73 MEN1 (0.61) KDM4EALOX15TSHRTDP1KMT2A
SCHEMBL17811481 0.73 PLK1 (0.39) HSD17B14KDM4EALOX15TSHRACMSD
SCHEMBL17811493 0.72 NR1H2 (0.38) NR1H2NR1H3HSD17B14
SCHEMBL17815472 0.71 MAOA (0.43) CYP1A2HSD17B14KDM4EMAPT

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-10005869-B2 Polymerisation initiators TRINSEO EUROPE GMBH (CH) 2018-06-26 US disclosed
US-20160159956-A1 Polymerisation Initiators TRINSEO EUROPE GMBH (CH) 2016-06-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10005869-B2 Polymerisation initiators ELOVL5, ELOVL3, ELOVL1 NR1H2 3711/4885NR1H3 3601/4885CYP1A2 861/4885
US-20160159956-A1 Polymerisation Initiators ELOVL5, ELOVL3, ELOVL1 NR1H2 3711/4885NR1H3 3601/4885CYP1A2 861/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.