SCHEMBL4876725

SCHEMBL4876725

Cc1ccccc1-c1ccc2cc(-c3c(-c4ccccc4)c4sc(C(=O)O)cc4n3CC(=O)N3CCCC3)ccc2n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 2/20 0.41
GRIN2B Q13224 5/20 0.40
ALDH1A1 P00352 4/20 0.39
GAA P10253 2/20 0.39
TSHR P16473 4/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 4/20 0.36
MAPK1 P28482 2/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL4875250 0.99 KMT2A (0.41) KMT2AMEN1POLBGRIN2BALDH1A1
SCHEMBL4868476 0.90 GRIN2B (0.40) KMT2AMEN1GRIN2BALDH1A1GAA
SCHEMBL4877153 0.89 GRIN2B (0.40) GRIN2BMAPTRAB9A
SCHEMBL4877305 0.89 GRIN2B (0.43) KMT2AGRIN2BALDH1A1GAAHPGD
SCHEMBL4875238 0.88 ALDH1A1 (0.39) KMT2AMEN1POLBGRIN2BALDH1A1
SCHEMBL4876718 0.88 ALDH1A1 (0.39) KMT2AMEN1POLBGRIN2BALDH1A1
SCHEMBL4877137 0.88 CBX7 (0.39) POLBGRIN2BGAATSHRMAPT
SCHEMBL4876223 0.88 GRIN2B (0.39) KMT2AMEN1GRIN2BALDH1A1GAA
SCHEMBL3934917 0.87 GRIN2B (0.38) KMT2AMEN1GRIN2BALDH1A1GAA
SCHEMBL4868740 0.87 GRIN2B (0.41) KMT2AMEN1GRIN2BALDH1A1TSHR

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 KMT2A 4254/4885MEN1 4834/4885POLB 327/4885

“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.