SCHEMBL4872023

SCHEMBL4872023

COc1ccc(-c2ccc3cc(-c4c(-c5ccccc5)c5sc(C(=O)O)cc5n4Cc4ccncc4)ccc3n2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RIPK3 Q9Y572 1/20 0.34
STK17B O94768 1/20 0.34
PPARG P37231 2/20 0.34
CDK2 P24941 1/20 0.34
GSK3B P49841 1/20 0.34
DHODH Q02127 3/20 0.33
KIF11 P52732 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
CSF1R P07333 1/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
PTGER4 P35408 1/20 0.32

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
SCHEMBL4866909 0.91 ALOX5AP (0.35) RIPK3PPARGGRIN1GRIN2B
SCHEMBL4878284 0.89 MAOA (0.40) KDM4EALDH1A1SMN1; SMN2PPARGDHODH
SCHEMBL4875185 0.89 PPARG (0.40) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL4873278 0.88 GRIN1 (0.37) CYP17A1ALDH1A1RIPK3PPARGCDK2
SCHEMBL4879018 0.88 MAPK14 (0.37) KDM4EALDH1A1RIPK3DHODH
SCHEMBL4872012 0.86 MDM2 (0.35) CYP17A1STK17BCDK2GSK3BDHODH
SCHEMBL4877209 0.83 KDM4E (0.37) KDM4EALDH1A1SMN1; SMN2PPARG
SCHEMBL4868096 0.83 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2PPARG
SCHEMBL4867600 0.82 DHODH (0.38) ALDH1A1PPARGDHODH
SCHEMBL4872488 0.82 KCNH2 (0.35) PPARG

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 CYP17A1 3808/4885KDM4E 3075/4885NPC1 679/4885

“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.