SCHEMBL23142005

SCHEMBL23142005

CC(=O)c1ccc(OC2CCN(C(=O)OCc3ccccc3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
CYP2C19 P33261 1/20 0.56
LMNA P02545 1/20 0.53
MAOB P27338 1/20 0.51
HTT P42858 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LNPEP Q9UIQ6 1/20 0.49
SRD5A1 P18405 1/20 0.49
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
PDE4B Q07343 1/20 0.48
GRIN2B Q13224 5/20 0.48
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
GPR119 Q8TDV5 2/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL1649138 0.91 SMN1; SMN2 (0.61) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL1650184 0.89 SMN1; SMN2 (0.60) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL13198831 0.87 SMN1; SMN2 (0.63) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL21612929 0.86 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL1648387 0.86 SMN1; SMN2 (0.61) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL30120062 0.85 SMN1; SMN2 (0.60) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL4717723 0.84 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9ACYP2C19HTT
SCHEMBL6596647 0.84 SMN1; SMN2 (0.58) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL3319664 0.84 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9ACYP2C19LMNA
SCHEMBL6749185 0.83 HTT (0.59) SMN1; SMN2NPC1RAB9ACYP2C19LMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018023-B2 Heterocondensed pyridones compounds and their use as IDH inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2024-06-25 US disclosed
CN-112469719-B Heterocondensed pyridone compounds and their use as IDH inhibitors 内尔维亚诺医疗科学公司 2024-01-23 CN disclosed
EP-3797107-B1 HETEROCONDENSED PYRIDONE COMPOUNDS AND THEIR USE AS IDH INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2022-08-10 EP disclosed
US-20210206759-A1 HETEROCONDENSED PYRIDONES COMPOUNDS AND THEIR USE AS IDH INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2021-07-08 US disclosed
EP-3797107-A1 HETEROCONDENSED PYRIDONES COMPOUNDS AND THEIR USE AS IDH INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2021-03-31 EP disclosed
CN-112469719-A Heterocondensed pyridone compounds and their use as IDH inhibitors 内尔维亚诺医疗科学公司 2021-03-09 CN 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 (2 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-12018023-B2 Heterocondensed pyridones compounds and their use as IDH inhibitors IDH1, IDH2, IDH3A SMN1; SMN2 2100/4885NPC1 4480/4885RAB9A 3929/4885
US-20210206759-A1 HETEROCONDENSED PYRIDONES COMPOUNDS AND THEIR USE AS IDH INHIBITORS IDH1, IDH2, IDH3A SMN1; SMN2 2100/4885NPC1 4480/4885RAB9A 3929/4885

“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.