SCHEMBL4878064

SCHEMBL4878064

COc1ccccc1-c1ccc2cc(-c3c(-c4ccccc4)c4sc(C(=O)O)cc4n3CC(=O)N3CCCC3C)ccc2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HCRTR1 O43613 3/20 0.36
HCRTR2 O43614 3/20 0.36
KCNH2 Q12809 5/20 0.36
HRH3 Q9Y5N1 5/20 0.36
DAGLA Q9Y4D2 1/20 0.36
DHODH Q02127 1/20 0.36
PIK3CA P42336 1/20 0.35
DAGLB Q8NCG7 2/20 0.34

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
SCHEMBL4878059 0.91 KDM4E (0.38) KDM4EHTTNPSR1ALDH1A1POLB
SCHEMBL4874587 0.90 MAPT (0.36) KDM4EHTTNPSR1ALDH1A1POLB
SCHEMBL4876396 0.89 KCNH2 (0.36) KDM4EHTTNPSR1ALDH1A1POLB
SCHEMBL4875364 0.89 TP53 (0.34) KDM4ENPSR1ALDH1A1TP53HPGD
SCHEMBL4876066 0.89 KCNH2 (0.39) KDM4EHTTALDH1A1POLBTP53
SCHEMBL4878306 0.88 PIK3CA (0.40) KDM4EHTTNPSR1KCNH2DHODH
SCHEMBL4878862 0.87 KCNH2 (0.36) KDM4EALDH1A1POLBMAPK1KCNH2
SCHEMBL4865037 0.86 KCNH2 (0.37) ALDH1A1POLBMAPK1KCNH2HRH3
SCHEMBL4878281 0.86 KCNH2 (0.37) ALDH1A1POLBHPGDMAPK1KCNH2
SCHEMBL4875611 0.86 KCNH2 (0.45) ALDH1A1MAPK1HCRTR1HCRTR2KCNH2

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 KDM4E 3075/4885HTT 4667/4885NPSR1 4328/4885

“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.