SCHEMBL6506210

SCHEMBL6506210

CC(C)(C)[Si](C)(C)OCCn1cc(C(=O)N2CCN(c3cccc(C#N)c3)CC2)c(-c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 4/20 0.42
NOTUM Q6P988 1/20 0.39
SLC6A9 P48067 1/20 0.39
SMO Q99835 1/20 0.39
DRD2 P14416 4/20 0.39
DRD3 P35462 3/20 0.38
SLC6A7 Q99884 1/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
LMNA P02545 2/20 0.36
TP53 P04637 1/20 0.36
DHFR P00374 1/20 0.36
NAMPT P43490 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL6495942 0.87 PARP14 (0.41) DRD3FNTAFNTBLMNATSHR
SCHEMBL6502353 0.85 NOTUM (0.44) CHRM4NOTUMSLC6A9SMODRD2
SCHEMBL5761170 0.84 KDM4E (0.41) DRD2FNTAFNTBLMNATP53
SCHEMBL6494220 0.84 CHRM4 (0.42) CHRM4NOTUMSMODRD2DRD3
SCHEMBL1383360 0.83 NOTUM (0.46) CHRM4NOTUMSLC6A9SMODRD2
SCHEMBL5820729 0.82 SLC6A9 (0.39) CHRM4NOTUMSLC6A9SMOSLC6A7
SCHEMBL1384516 0.76 ABCG2 (0.48) CHRM4SMOSLC6A7FNTAFNTB
SCHEMBL1380695 0.75 SLC6A9 (0.45) CHRM4NOTUMSLC6A9SMODRD2
SCHEMBL1382166 0.74 DRD2 (0.48) CHRM4NOTUMSLC6A9SMODRD2
SCHEMBL5820248 0.74 CHRM4 (0.39) CHRM4SLC6A9SMODRD2DRD3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AVENTIS PHARMA S.A. (FR) 2005-01-20 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 (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-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AHR, ARNT, MYC CHRM4 4347/4885NOTUM 3896/4885SLC6A9 4785/4885

“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.