SCHEMBL12509554

SCHEMBL12509554

COc1ccc(C(=O)Nc2ccc(-c3nc4ccc(OC)cc4s3)c(OC)c2)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.59
MAPT P10636 12/20 0.56
RXFP1 Q9HBX9 3/20 0.55
LMNA P02545 2/20 0.55
RAB9A P51151 5/20 0.53
NPC1 O15118 4/20 0.53
POLB P06746 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
THRB P10828 1/20 0.52
SCD O00767 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
DCLK1 O15075 1/20 0.49
FES P07332 1/20 0.49
PIM1 P11309 1/20 0.49
CDK2 P24941 1/20 0.49
GSK3A P49840 1/20 0.49
GSK3B P49841 1/20 0.49
IRAK1 P51617 1/20 0.49
MAP4K2 Q12851 1/20 0.49

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
SCHEMBL1984364 0.90 RAB9A (0.64) TP53MAPTRAB9ANPC1POLB
SCHEMBL12509328 0.87 TP53 (0.55) TP53MAPTLMNARAB9ANPC1
SCHEMBL12421996 0.87 TP53 (0.63) TP53MAPTRXFP1LMNARAB9A
SCHEMBL2193778 0.87 MAPT (0.54) TP53MAPTLMNARAB9ANPC1
SCHEMBL12509613 0.85 MAPT (0.70) TP53MAPTRXFP1LMNARAB9A
SCHEMBL2191406 0.83 TP53 (0.51) TP53MAPTLMNARAB9ANPC1
SCHEMBL12422193 0.81 MAPT (0.67) TP53MAPTRXFP1LMNARAB9A
SCHEMBL16623331 0.80 APP (0.69) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL2194594 0.80 SCD (0.58) TP53MAPTRXFP1LMNARAB9A
SCHEMBL12421994 0.79 MAPT (0.68) TP53MAPTRXFP1LMNARAB9A

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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES MAPT, PRNP, MAP4 TP53 94/4885MAPT 1/4885RXFP1 3017/4885

“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.