SCHEMBL5113620

SCHEMBL5113620

CC(C)(C)[Si](OCc1cc(O)cc(COc2ccc(Cl)cc2Cl)c1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 14/20 0.48
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 1/20 0.43
MDM2 Q00987 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
TP53 P04637 2/20 0.43
STAT3 P40763 1/20 0.41
STAT1 P42224 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL5109504 0.89 MRGPRX4 (0.46) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL17803752 0.78 ACLY (0.34) SMN1; SMN2MAPTTP53KMT2AMEN1
SCHEMBL16818604 0.76 TACR1 (0.34) MRGPRX4SMN1; SMN2KMT2AMEN1
SCHEMBL5120954 0.76 TACR1 (0.32) SMN1; SMN2RAB9AALDH1A1POLB
SCHEMBL31124766 0.74 TSHR (0.35) SMN1; SMN2HTT
SCHEMBL8149467 0.73 GABRA1 (0.41) SMN1; SMN2MAPTKMT2A
SCHEMBL31124717 0.71 TRPA1 (0.35) SMN1; SMN2ALDH1A1HTT
SCHEMBL9347235 0.71 ESR1 (0.43) ALDH1A1MAPTTP53KMT2AMEN1
SCHEMBL5106543 0.71 CYP4F2 (0.42) SMN1; SMN2RAB9AL3MBTL1ALDH1A1MAPT
SCHEMBL1314001 0.70 AGXT (0.42) SMN1; SMN2L3MBTL1ALDH1A1MAPTHTT

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-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 EP 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 (1 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 MRGPRX4 826/4885HPGD 4473/4885SMN1; SMN2 3876/4885

“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.