SCHEMBL7904646

SCHEMBL7904646

Nc1ccc(Oc2ncccc2-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
FEN1 P39748 2/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
APAF1 O14727 1/20 0.51
MAOA P21397 1/20 0.48
PDE10A Q9Y233 2/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL2455636 0.90 PDE10A (0.58) NCOA1NCOA3FEN1MEN1KMT2A
SCHEMBL27648901 0.88 MEN1 (0.58) FEN1MEN1KMT2APDE10AALDH1A1
SCHEMBL4477069 0.82 MEN1 (0.46) FEN1MEN1KMT2APDE10AALDH1A1
SCHEMBL31272745 0.81 PDE10A (0.58) FEN1MEN1KMT2APDE10AALDH1A1
SCHEMBL587812 0.81 MEN1 (0.49) FEN1MEN1KMT2AAPAF1PDE10A
SCHEMBL2456284 0.80 PDE10A (0.56) FEN1MEN1KMT2AAPAF1PDE10A
SCHEMBL14878632 0.80 PDE10A (0.58) FEN1PDE10A
SCHEMBL13282513 0.79
SCHEMBL14878634 0.79 PDE10A (0.60) MEN1KMT2APDE10A
SCHEMBL581393 0.78 PDE10A (0.56) FEN1MEN1KMT2APDE10AALDH1A1

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-8637500-B2 Aminopyridine and carboxypyridine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2014-01-28 US disclosed
US-8637500-B2 Aminopyridine and carboxypyridine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2014-01-28 US disclosed
EP-2376455-B1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC (US) 2012-11-14 EP disclosed
WO-2010077992-A1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-07-08 WO disclosed
US-20100160280-A1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-06-24 US disclosed
US-20100160280-A1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-06-24 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-20100160280-A1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE4A, PDE7A, PDE4D NCOA1 3999/4885NCOA3 3450/4885FEN1 1703/4885

“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.