SCHEMBL4876271

SCHEMBL4876271

Nc1cccc(-c2ccc3cc(-c4c(-c5ccccc5)c5sc(C(=O)O)cc5n4CC(=O)N4CCSCC4)ccc3n2)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
GRIN2B Q13224 2/20 0.31
GRM5 P41594 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.30
IRAK4 Q9NWZ3 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
SCHEMBL4878029 0.92 SMO (0.34) ALDH1A1GAAKMT2ASMN1; SMN2MAPT
SCHEMBL4877234 0.91 IRAK4 (0.31) GRM5MAPTIRAK4
SCHEMBL4876257 0.88 ALDH1A1 (0.34) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4874753 0.88 KDM4E (0.40) HPGDRAB9AGRM5ALDH1A1GAA
SCHEMBL4873226 0.87 CBX7 (0.39) GRIN2BGAAIRAK4
SCHEMBL4868356 0.87 MAPT (0.35) HPGDRAB9AALDH1A1KMT2ASMN1; SMN2
SCHEMBL3938012 0.85 KCNH2 (0.35) HPGDRAB9AGRIN2BGRM5SMN1; SMN2
SCHEMBL4876599 0.84 DPP4 (0.33) MAPT
SCHEMBL4877305 0.84 GRIN2B (0.43) HPGDRAB9AGRIN2BGRM5ALDH1A1
SCHEMBL4879016 0.83 KMT2A (0.36) GRIN2BKMT2A

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-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 HPGD 2973/4885RAB9A 1055/4885GRIN2B 3420/4885

“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.