SCHEMBL4126263

SCHEMBL4126263

COC(=O)c1c(C)c(-c2cccc3cccnc23)cc(C(C)(C)C)c1OC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
POLB P06746 4/20 0.43
HPGD P15428 1/20 0.42
ALDH1A1 P00352 2/20 0.40
SLC40A1 Q9NP59 3/20 0.39
MAPT P10636 3/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 2/20 0.37
EGLN1 Q9GZT9 1/20 0.37
HCRTR1 O43613 1/20 0.37
ALOX15 P16050 1/20 0.37
HTT P42858 1/20 0.37
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
MECP2 P51608 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL4126795 0.84 SMN1; SMN2 (0.43) MEN1KMT2AMAPTLMNAALOX15
SCHEMBL4121518 0.82 KDM4E (0.42) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4123242 0.81 ALOX15 (0.48) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL4126049 0.78 GLRA3 (0.44) POLBALDH1A1LMNARAB9AHTT
SCHEMBL4121059 0.77 CYP11B1 (0.42) MEN1KMT2AHPGDALDH1A1
SCHEMBL4120806 0.76 POLQ (0.42) MEN1KMT2APOLBHPGDALDH1A1
SCHEMBL4128033 0.76 SLC6A3 (0.51) MEN1KMT2AHPGDALDH1A1LMNA
SCHEMBL4123695 0.73 KDM4E (0.43) MEN1KMT2APOLBHPGDALDH1A1
SCHEMBL4122975 0.73 TNFRSF1A (0.42) HPGDALDH1A1
SCHEMBL4126942 0.72 ALPL (0.42) HPGDALDH1A1MAPTRAB9ATP53

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 3 patents. 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
EP-1890993-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR ANTAGONISTS OF GLYR AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006121390-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR AGONISTS OF GLYR ASTRAZENECA AB (SE) 2006-11-16 WO 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 MEN1 2512/4885KMT2A 2465/4885POLB 4477/4885

“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.