SCHEMBL970079

SCHEMBL970079

Cc1cc(N2CCOCC2)nc(C)c1NC(=O)CCC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
HSD17B10 Q99714 9/20 0.49
KDM4E B2RXH2 8/20 0.49
HPGD P15428 8/20 0.49
GAA P10253 8/20 0.49
GLA P06280 6/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
CYP1A2 P05177 2/20 0.49
RAB9A P51151 10/20 0.46
NPC1 O15118 9/20 0.46
MAPT P10636 4/20 0.46
GBA1 P04062 1/20 0.46
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
POLB P06746 2/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL972064 0.94 KDM4E (0.48) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL969756 0.84 RAB9A (0.54) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL970575 0.83 RAB9A (0.53) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL969831 0.83 RAB9A (0.53) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL2434625 0.82 ALDH1A1 (0.50) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL970263 0.82 KCNQ2 (0.56) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL30824695 0.82 KCNQ2 (0.56) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL30794894 0.82 LMNA (0.49) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL969579 0.82 LMNA (0.49) ALDH1A1HSD17B10KDM4EHPGDGAA
SCHEMBL969661 0.82 GBA1 (0.67) ALDH1A1HSD17B10KDM4EHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2298766-B1 Pharmaceutical formulations comrpising a substituted pyridine derivative LUNDBECK & CO AS H (DK) 2013-09-18 EP claimed
US-8299071-B2 Substituted pyridine derivatives H. LUNDBECK A/S (DK) 2012-10-30 US claimed
EP-2298766-A1 Substituted pyridine derivatives H. Lundbeck A/S (DK) 2011-03-23 EP claimed
US-20110003811-A1 SUBSITUTED PYRIDINE DERIVATIVES H. LUNDBECK A/S (DK) 2011-01-06 US claimed
EP-4584250-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS Biohaven Therapeutics Ltd. (VG) 2025-07-16 EP disclosed
EP-4580679-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS Biohaven Therapeutics Ltd. (VG) 2025-07-09 EP disclosed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 WO disclosed
EP-2298766-A1 Substituted pyridine derivatives H. Lundbeck A/S (DK) 2011-03-23 EP disclosed
US-20110003811-A1 SUBSITUTED PYRIDINE DERIVATIVES H. LUNDBECK A/S (DK) 2011-01-06 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-20110003811-A1 SUBSITUTED PYRIDINE DERIVATIVES KCNQ2, KCNQ1, KCNQ5 ALDH1A1 2209/4885HSD17B10 2806/4885KDM4E 666/4885

“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.