SCHEMBL4126795

SCHEMBL4126795

COC(=O)c1c(C)c(-c2cccc3ncccc23)cc(C(C)(C)C)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLQ O75417 1/20 0.42
MAPK8 P45983 2/20 0.41
MAPK9 P45984 2/20 0.41
MAPK10 P53779 2/20 0.41
XIAP P98170 1/20 0.40
BIRC2 Q13490 1/20 0.40
ERN1 O75460 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
PABPC1 P11940 1/20 0.39
EIF4H Q15056 1/20 0.39
NUDT1 P36639 1/20 0.39
ACVR1 Q04771 1/20 0.38
RECQL P46063 1/20 0.37

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
SCHEMBL4126263 0.84 MEN1 (0.43) SMN1; SMN2MEN1KMT2AMAPTLMNA
SCHEMBL4121518 0.84 KDM4E (0.42) SMN1; SMN2L3MBTL1MEN1KMT2ARECQL
SCHEMBL4123242 0.80 ALOX15 (0.48) MEN1KMT2AMAPTALOX15HTT
SCHEMBL4129283 0.78 SLC22A12 (0.45) ERN1SLC22A12MEN1KMT2APABPC1
SCHEMBL4121059 0.76 CYP11B1 (0.42) ERN1SLC22A12MEN1KMT2AKDM4E
SCHEMBL4120806 0.75 POLQ (0.42) SMN1; SMN2HSD17B10L3MBTL1POLQSLC22A12
SCHEMBL4114952 0.72 CYP3A4 (0.42) SMN1; SMN2HSD17B10L3MBTL1KDM4EMAPT
SCHEMBL4126942 0.71 ALPL (0.42) RECQLKDM4EMAPT
SCHEMBL4128033 0.70 SLC6A3 (0.51) HSD17B10ERN1MEN1KMT2AKDM4E
SCHEMBL4127663 0.70 CNR2 (0.39) HSD17B10SLC22A12MAPTADRA2CLMNA

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 SMN1; SMN2 2423/4885HSD17B10 1799/4885L3MBTL1 3557/4885

“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.