SCHEMBL4877332

SCHEMBL4877332

CN(C)CC1CN(C(=O)Cn2c(-c3ccc4nc(-c5ccccc5F)ccc4c3)c(C3CCCCC3)c3sc(C(=O)O)cc32)CCO1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.35
SLC8A1 P32418 1/20 0.34
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
SMO Q99835 1/20 0.32
GRIN2B Q13224 4/20 0.31
PRKCA P17252 1/20 0.30
MMP12 P39900 1/20 0.30
HRH1 P35367 1/20 0.30
GRM5 P41594 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
SCHEMBL4877344 0.90 SCN9A (0.37) SCN9ASLC8A1MEN1NPC1RAB9A
SCHEMBL3931763 0.89 GRIN2B (0.39) KMT2AALOX5APFEN1SMOGRIN2B
SCHEMBL4876035 0.88 GRIN2B (0.39) ALOX5APFEN1SMOGRIN2BHRH1
SCHEMBL4877357 0.88 KCNH2 (0.34) SCN9ASLC8A1
SCHEMBL4877145 0.88 GRIN2B (0.37) MEN1NPC1RAB9AKMT2ASMO
SCHEMBL4874831 0.87 ALDH1A1 (0.36) SCN9ASLC8A1NPC1RAB9ASMO
SCHEMBL4866924 0.87 KCNH2 (0.34) SCN9ASLC8A1
SCHEMBL4866857 0.87 KCNH2 (0.34) SCN9ASLC8A1
SCHEMBL4870793 0.86 CBX7 (0.37) KMT2ASMOGRIN2BHRH1
SCHEMBL4875214 0.85 KMT2A (0.33) MEN1NPC1RAB9AKMT2AALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 SCN9A 2977/4885SLC8A1 3881/4885MEN1 4834/4885

“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.