SCHEMBL4875185

SCHEMBL4875185

COc1ccc(-c2ccc3cc(-c4c(-c5ccccc5)c5sc(C(=O)O)cc5n4Cc4ccncc4)ccc3n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.40
PDE5A O76074 1/20 0.40
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 2/20 0.39
NFKB1 P19838 2/20 0.39
RAB9A P51151 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39
ACP1 P24666 3/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
LMNA P02545 2/20 0.39
ATM Q13315 1/20 0.39
BCHE P06276 1/20 0.39
HTT P42858 2/20 0.38
TP53 P04637 1/20 0.38
MAOA P21397 1/20 0.38

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
SCHEMBL4879018 0.90 MAPK14 (0.37) ALDH1A1KDM4EMAOAMAOBALOX5AP
SCHEMBL4878284 0.89 MAOA (0.40) PPARGALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL4872023 0.89 CYP17A1 (0.36) PPARGALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL4873278 0.87 GRIN1 (0.37) PPARGALDH1A1ALOX5APCYP3A4
SCHEMBL4866909 0.87 ALOX5AP (0.35) PPARGALOX5APCYP3A4
SCHEMBL4871792 0.86 PPARG (0.41) PPARGALDH1A1MAPTHPGDLMNA
SCHEMBL4877209 0.86 KDM4E (0.37) PPARGALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL4868096 0.86 KDM4E (0.39) PPARGALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL4878878 0.85 LMNA (0.40) PPARGALDH1A1KDM4EMAPTHPGD
SCHEMBL4872488 0.85 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 PPARG 2954/4885PDE5A 1673/4885ALDH1A1 1357/4885

“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.