SCHEMBL4128093

SCHEMBL4128093

COC(=O)c1c(C)c(C(=O)c2ccc(C)cc2)cc(C(C)(C)C)c1OC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 7/20 0.41
LMNA P02545 4/20 0.41
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 5/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TNFRSF1A P19438 1/20 0.36
AKR1C3 P42330 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL4134212 0.88 ALDH1A1 (0.41) ALDH1A1LMNAGAAMAPTNPC1
SCHEMBL4113737 0.86 TAS1R3 (0.39) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL4123787 0.83 MAPT (0.41) ALDH1A1LMNAKDM4EGAAMAPT
SCHEMBL4117083 0.81 PTGS1 (0.39) ALDH1A1LMNAKDM4EHPGDMAPT
SCHEMBL4125922 0.80 PTPN1 (0.43) TDP1KDM4ENPC1RAB9AL3MBTL1
SCHEMBL4134426 0.79 ALDH1A1 (0.46) TDP1ALDH1A1LMNAHPGDGAA
SCHEMBL4121697 0.79 MAPT (0.44) ALDH1A1MAPTPOLBRAB9AMEN1
SCHEMBL4115886 0.79 SMN1; SMN2 (0.38) ALDH1A1LMNAKDM4EGAATNFRSF1A
SCHEMBL4122587 0.77 ADRA2A (0.36) TDP1ALDH1A1KDM4EHPGDNPSR1
SCHEMBL4135380 0.74 NPC1 (0.49) ALDH1A1LMNAHPGDMAPTNPSR1

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-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR ASTRAZENECA AB (SE) 2009-07-30 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-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR GLRA1, GLRB, GPBAR1 TDP1 3398/4885ALDH1A1 1413/4885LMNA 2299/4885

“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.