SCHEMBL12125451

SCHEMBL12125451

CC(C)C1CCN(C(=O)OC(C)(C)C)CC1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.47
▸ RECQL P46063 1/20 0.44
▸ EPHX1 P07099 1/20 0.44
▸ MAPT P10636 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ USP2 O75604 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GPR119 Q8TDV5 4/20 0.42
▸ USP30 Q70CQ3 1/20 0.41
▸ NR1H2 P55055 1/20 0.41
▸ PTPN2 P17706 1/20 0.41

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
SCHEMBL28627461 0.88 HPGD (0.44) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL23826429 0.88 HPGD (0.44) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL23825762 0.88 HPGD (0.44) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL23825764 0.88 HPGD (0.44) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL28627459 0.88 HPGD (0.44) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL23826432 0.88 HPGD (0.44) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL15140593 0.86 HPGD (0.46) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL15140592 0.86 HPGD (0.46) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL25010445 0.85 NR1H2 (0.47) HPGDRECQLEPHX1MAPTALDH1A1
SCHEMBL30841080 0.84 HPGD (0.43) HPGDRECQLEPHX1MAPTALDH1A1

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-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 — — US disclosed
US-8883828-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC. (US) 2014-11-11 — — US disclosed
US-20130065901-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2013-03-14 — — US disclosed
US-8354540-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC. (US) 2013-01-15 — — US disclosed
US-20110281874-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2011-11-17 — — 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-20130065901-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 HPGD 704/4885RECQL 2971/4885EPHX1 4374/4885
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 HPGD 3349/4885RECQL 3891/4885EPHX1 3732/4885
US-20110281874-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 HPGD 704/4885RECQL 2971/4885EPHX1 4374/4885

“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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