SCHEMBL6418643

SCHEMBL6418643

CC(C)(C)c1ccc(C(=O)Nc2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.75
TP53 P04637 1/20 0.75
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
HDAC3 O15379 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
HDAC11 Q96DB2 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
KCNK9 Q9NPC2 1/20 0.56
KDM4E B2RXH2 2/20 0.56
MAPK1 P28482 2/20 0.56
TRPV1 Q8NER1 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
LMNA P02545 2/20 0.53
KCNK3 O14649 1/20 0.51
NR1H4 Q96RI1 1/20 0.51
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL5973321 0.92 MAPT (0.67) MAPTTP53MEN1KMT2ASMN1; SMN2
SCHEMBL5972887 0.81 MEN1 (0.60) MAPTTP53MEN1KMT2ASMN1; SMN2
SCHEMBL5972372 0.80 SMN1; SMN2 (0.62) MAPTTP53MEN1KMT2ASMN1; SMN2
SCHEMBL7303163 0.78 HDAC3 (0.86) MAPTMEN1KMT2ASMN1; SMN2HDAC3
SCHEMBL13483892 0.77 NPC1 (0.71) MAPTMEN1KMT2AHDAC3HDAC6
SCHEMBL13483891 0.77 ESR1 (0.76) MAPTMEN1KMT2ASMN1; SMN2HDAC3
SCHEMBL22718631 0.76 MAOA (0.56) TP53MEN1KMT2ASMN1; SMN2HDAC3
SCHEMBL13293334 0.76 MAPT (0.78) MAPTTP53MEN1KMT2ASMN1; SMN2
SCHEMBL20773177 0.76 MAPT (0.68) MAPTTP53MEN1KMT2AKDM4E
SCHEMBL24601353 0.76 MAOA (0.52) MAPTMEN1KMT2ASMN1; SMN2HDAC3

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-20050004133-A1 Modulators of VR1 receptor VERTEX PHARMACEUTICALS INCORPORATED 2005-01-06 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-20050004133-A1 Modulators of VR1 receptor TRPV1, TRPV2, TRPV3 MAPT 4434/4885TP53 3827/4885MEN1 3939/4885

“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.