SCHEMBL14842201

SCHEMBL14842201

CCOC(=O)C1CC1c1cc(Cl)nc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 7/20 0.38
▸ CA2 P00918 7/20 0.38
▸ CA9 Q16790 6/20 0.38
▸ CA12 O43570 4/20 0.38
▸ KMT2A Q03164 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ MAP3K5 Q99683 1/20 0.33
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33

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
SCHEMBL24737343 0.81 KMT2A (0.39) CA1CA2CA9CA12KMT2A
SCHEMBL29880067 0.81 KMT2A (0.39) CA1CA2CA9CA12KMT2A
SCHEMBL19013571 0.78 KDM4E (0.40) CA1CA2CA9CA12KMT2A
SCHEMBL18989655 0.78 KDM4E (0.40) CA1CA2CA9CA12KMT2A
SCHEMBL20592220 0.78 KDM4E (0.40) CA1CA2CA9CA12KMT2A
SCHEMBL22503762 0.78 KMT2A (0.43) CA1CA2CA9CA12KMT2A
SCHEMBL20442243 0.78 KMT2A (0.43) CA1CA2CA9CA12KMT2A
SCHEMBL20424215 0.78 KMT2A (0.43) CA1CA2CA9CA12KMT2A
SCHEMBL20398734 0.78 KMT2A (0.43) CA1CA2CA9CA12KMT2A
SCHEMBL30123091 0.78 KMT2A (0.43) CA1CA2CA9CA12KMT2A

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 19 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-2919782-B1 SECONDARY ALCOHOL SUBSITUTED TRIAZOLES AS PDE10 INHIBITORS MERCK SHARP & DOHME (US) 2017-04-26 — — EP disclosed
EP-2919782-B1 SECONDARY ALCOHOL SUBSITUTED TRIAZOLES AS PDE10 INHIBITORS MERCK SHARP & DOHME (US) 2017-04-26 — — EP disclosed
US-9428492-B2 Secondary alcohol substituted triazoles as PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2016-08-30 — — US disclosed
US-9428492-B2 Secondary alcohol substituted triazoles as PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2016-08-30 — — US disclosed
US-9428492-B2 Secondary alcohol substituted triazoles as PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2016-08-30 — — 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-9200001-B2 Triazolyl PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-01 — — US disclosed
US-20150284368-A1 SECONDARY ALCOHOL SUBSTITUTED TRIAZOLES AS PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-08 — — US disclosed
US-20150284368-A1 SECONDARY ALCOHOL SUBSTITUTED TRIAZOLES AS PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-08 — — US disclosed
US-20150284368-A1 SECONDARY ALCOHOL SUBSTITUTED TRIAZOLES AS PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-08 — — US disclosed
EP-2919782-A1 SECONDARY ALCOHOL SUBSITUTED TRIAZOLES AS PDE10 INHIBITORS Merck Sharp & Dohme Corp. (US) 2015-09-23 — — EP 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-2014078220-A1 SECONDARY ALCOHOL SUBSITUTED TRIAZOLES AS PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-05-22 — — 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 (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-20140249134-A1 TRIAZOLYL PDE10 INHIBITORS PDE10A, PDE12, PDE4A CA1 3306/4885CA2 3428/4885CA9 2386/4885
US-20150284368-A1 SECONDARY ALCOHOL SUBSTITUTED TRIAZOLES AS PDE10 INHIBITORS PDE10A, PDE3A, PDE4B CA1 3220/4885CA2 4469/4885CA9 2604/4885

“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.

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