SCHEMBL2037136

SCHEMBL2037136

Cn1cc(-c2ccsc2)nc1C=O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 8/20 0.52
AR P10275 1/20 0.38
ADORA2A P29274 3/20 0.37
ADORA3 P0DMS8 2/20 0.37
ADORA1 P30542 2/20 0.37
HRH4 Q9H3N8 1/20 0.37
ADORA2B P29275 1/20 0.37
FYN P06241 1/20 0.36
ERN1 O75460 1/20 0.36
IRAK4 Q9NWZ3 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
SCHEMBL259283 0.77 PDE10A (0.48) PDE10AADORA2AADORA1
SCHEMBL12641898 0.76 RAB9A (0.46) PDE10A
SCHEMBL31326500 0.74 PTGS1 (0.42) PDE10AARADORA2AADORA3ADORA1
SCHEMBL12641920 0.74 TLR8 (0.43) PDE10AADORA2AADORA3ADORA1HRH4
SCHEMBL2039989 0.72 PDE10A (0.52) PDE10A
SCHEMBL6902589 0.72 PDE10A (0.52) PDE10AADORA2AADORA3ADORA2BERN1
SCHEMBL7512631 0.72 PDE10A (0.45) PDE10A
SCHEMBL2042236 0.72 PDE10A (0.54) PDE10A
SCHEMBL14122433 0.70 PDE10A (1.00) PDE10A
SCHEMBL2038582 0.70 PDE10A (1.00) PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9669029-B2 Heteroaromatic phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2017-06-06 US disclosed
US-20150290191-A1 Heteroaromatic Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2015-10-15 US disclosed
CN-102741250-B As the heteroaromatic phenylimidazole derivatives of PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2015-10-14 CN disclosed
US-9096589-B2 Heteroaromatic phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2015-08-04 US disclosed
EP-2513107-B1 HETEROAROMATIC PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS LUNDBECK & CO AS H (DK) 2014-07-30 EP disclosed
US-20120309714-A1 Heteroaromatic Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2012-12-06 US disclosed
EP-2513107-A1 HETEROAROMATIC PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. Lundbeck A/S (DK) 2012-10-24 EP disclosed
CN-102741250-A Heteroaromatic phenylimidazole derivatives as PDE10A enzyme inhibitors LUNDBECK & CO AS H 2012-10-17 CN disclosed
WO-2011072694-A1 HETEROAROMATIC PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2011-06-23 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 (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-20120309714-A1 Heteroaromatic Phenylimidazole derivatives as PDE10A enzyme inhibitors PDE10A, PDE3B, PDE4A PDE10A 1/4885AR 1785/4885ADORA2A 188/4885
US-20150290191-A1 Heteroaromatic Phenylimidazole derivatives as PDE10A enzyme inhibitors PDE10A, PDE3B, PDE12 PDE10A 1/4885AR 1736/4885ADORA2A 231/4885

“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.