SCHEMBL14844762

SCHEMBL14844762

Cc1cc(-n2nc(C)nc2C)cc(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
HTT P42858 2/20 0.41
RECQL P46063 1/20 0.39
MAPK10 P53779 4/20 0.36
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
PDE10A Q9Y233 5/20 0.32

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
SCHEMBL14844721 0.75 ALDH1A1 (0.33) ALDH1A1RECQLMAPK10PDE10A
SCHEMBL14842554 0.73 PDE10A (0.48) PDE10A
SCHEMBL12830382 0.72 MAPK10 (0.39) ALDH1A1RECQLMAPK10PDE10A
SCHEMBL20320623 0.72 KMT2A (0.53) ALDH1A1MAPK10KMT2ALMNA
SCHEMBL24142314 0.71 MAPK10 (0.42) MAPK10PDE10A
SCHEMBL14842202 0.71 PDE10A (0.41) ALDH1A1RECQLPDE10A
SCHEMBL16202022 0.70 GAA (0.48) ALDH1A1HTTKMT2ALMNA
SCHEMBL25694758 0.70 PDE10A (0.40) MAPK10PDE10A
SCHEMBL3084534 0.69 HTT (0.42) HTTMAPK10PDE10A
SCHEMBL19687283 0.68 HTT (0.62) ALDH1A1HTTKMT2ALMNA

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-2763533-B1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME (US) 2021-12-29 EP disclosed
EP-2763533-B1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME (US) 2021-12-29 EP disclosed
US-9200001-B2 Triazolyl PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-01 US disclosed
US-9200001-B2 Triazolyl PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-01 US disclosed
US-9200001-B2 Triazolyl PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-01 US disclosed
US-20140249134-A1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME LLC 2014-09-04 US disclosed
US-20140249134-A1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME LLC 2014-09-04 US disclosed
US-20140249134-A1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME LLC 2014-09-04 US disclosed
EP-2763533-A1 TRIAZOLYL PDE10 INHIBITORS Merck Sharp & Dohme Corp. (US) 2014-08-13 EP disclosed
WO-2013052526-A1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-04-11 WO disclosed
WO-2013052526-A1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-04-11 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-20140249134-A1 TRIAZOLYL PDE10 INHIBITORS PDE10A, PDE12, PDE4A ALDH1A1 1263/4885HTT 54/4885RECQL 1597/4885

“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.