SCHEMBL16623939

SCHEMBL16623939

COc1ccc(-c2cc(=O)c3c(OC)c(C=O)c(C=O)cc3o2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.66
MEN1 O00255 5/20 0.66
KMT2A Q03164 5/20 0.66
FLT3 P36888 4/20 0.61
MAPT P10636 6/20 0.59
NPC1 O15118 5/20 0.59
RAB9A P51151 5/20 0.59
NFKB1 P19838 2/20 0.59
NFKB2 Q00653 2/20 0.59
RELA Q04206 2/20 0.59
POLB P06746 2/20 0.59
KIT P10721 1/20 0.59
OPRD1 P41143 1/20 0.59
ABCB1 P08183 3/20 0.58
CYP3A4 P08684 5/20 0.58
MAOB P27338 4/20 0.58
TP53 P04637 4/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
LMNA P02545 3/20 0.58
KCNA5 P22460 3/20 0.58

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
SCHEMBL16623936 0.86 ABCB1 (0.70) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL18922767 0.84 ABCB1 (0.69) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL16623938 0.81 ALDH1A1 (0.74) ALDH1A1MEN1KMT2AFLT3MAPT
Tetramethylscutellarein SCHEMBL739115 0.80 MEN1 (1.00) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL8063178 0.78 FLT3 (0.83) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL18922798 0.78 ABCG2 (0.70) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL29504103 0.77 FLT3 (0.81) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL28732976 0.77 FLT3 (0.81) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL6932015 0.77 MEN1 (0.79) ALDH1A1MEN1KMT2AFLT3MAPT
SCHEMBL10031424 0.77 FLT3 (0.84) ALDH1A1MEN1KMT2AFLT3MAPT

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-20150098926-A1 Methods of Treating Hepatitis C Virus Infection THE J. DAVID GLADSTONE INSTITUTES 2015-04-09 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-20150098926-A1 Methods of Treating Hepatitis C Virus Infection HAVCR2, LIPC, FABP1 ALDH1A1 908/4885MEN1 4813/4885KMT2A 3148/4885

“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.