SCHEMBL2508884

SCHEMBL2508884

CCOC(=O)[C@@H]1CCC(=O)C[C@H]1c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.47
▸ HTT P42858 1/20 0.47
▸ PKM P14618 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL21611469 0.84 MAPT (0.60) MAPTHTTPKMALDH1A1CYP1A2
SCHEMBL2018293 0.84 MAPT (0.60) MAPTHTTPKMALDH1A1CYP1A2
SCHEMBL21611472 0.84 MAPT (0.60) MAPTHTTPKMALDH1A1CYP1A2
SCHEMBL15194525 0.82 DDB1 (0.39) MAPTCYP1A2CYP2C19MEN1KMT2A
SCHEMBL6082005 0.79 TSHR (0.49) MAPTHTTPKMALDH1A1CYP1A2
SCHEMBL18810302 0.79 MAPT (0.40) MAPTPKMALDH1A1CA1CA2
SCHEMBL22728078 0.79 MAPT (0.40) MAPTPKMALDH1A1CA1CA2
SCHEMBL17057064 0.79 MAPT (0.40) MAPTPKMALDH1A1CA1CA2
SCHEMBL17057061 0.79 MAPT (0.40) MAPTPKMALDH1A1CA1CA2
SCHEMBL2504165 0.79 MAPT (0.40) MAPTPKMALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243290-A1 Aminopyrimidines as SYK Inhibitors ALTMAN MICHAEL D (US) 2014-08-28 — — US disclosed
US-8759366-B2 Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME CORP. (US) 2014-06-24 — — US disclosed
US-8551984-B2 Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME CORP. (US) 2013-10-08 — — US disclosed
US-20120277192-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2012-11-01 — — US disclosed
US-20110245205-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2011-10-06 — — 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 (3 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-20110245205-A1 AMINOPYRIMIDINES AS SYK INHIBITORS SYK, BTK, LCK MAPT 3486/4885HTT 4827/4885PKM 1288/4885
US-20140243290-A1 Aminopyrimidines as SYK Inhibitors SYK, BTK, LCK MAPT 3486/4885HTT 4827/4885PKM 1288/4885
US-20120277192-A1 AMINOPYRIMIDINES AS SYK INHIBITORS SYK, BTK, LCK MAPT 3486/4885HTT 4827/4885PKM 1288/4885

“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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