SCHEMBL3316633

SCHEMBL3316633

Cc1cccc(C(C)NC2CN(C(=O)O)C2)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.44
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ACP3 P15309 1/20 0.39
SOS1 Q07889 8/20 0.39
GPR139 Q6DWJ6 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
BRD4 O60885 1/20 0.38
HSD17B2 P37059 1/20 0.38

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
SCHEMBL3317146 0.82 L3MBTL1 (0.42) SLC6A9GAAL3MBTL1
SCHEMBL21938280 0.79 GAA (0.56) GAAL3MBTL1SOS1BRD4
SCHEMBL3314526 0.78 CACNA2D1 (0.43) GPR139BRD4
SCHEMBL3315968 0.75 ADRB2 (0.48) GAAL3MBTL1
SCHEMBL30672690 0.74 GAA (0.55) GAAL3MBTL1
SCHEMBL3317174 0.74 HRH4 (0.39) GAAL3MBTL1KMT2A
SCHEMBL3317207 0.74 CASR (0.42) GAAL3MBTL1GPR139MEN1KMT2A
SCHEMBL3315251 0.74 ACACB (0.52) GAAL3MBTL1MEN1KMT2A
SCHEMBL3318604 0.73 KDM1A (0.49) MEN1KMT2A
SCHEMBL3310959 0.72 PANK3 (0.42) GAAL3MBTL1GPR139

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-20100105651-A1 ANTAGONISTS OF SNS SODIUM CHANNELS VERNALIS (R&D) LIMITED (GB) 2010-04-29 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-20100105651-A1 ANTAGONISTS OF SNS SODIUM CHANNELS CNR1, OPRL1, CHRNA10 SLC6A9 666/4885GAA 4162/4885L3MBTL1 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.