SCHEMBL2640496

SCHEMBL2640496

CC(C)(C)OC(=O)N1CCNCC1c1cccc(N)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 14/20 0.45
NR1H3 Q13133 10/20 0.45
RXRA P19793 2/20 0.39
RIPK1 Q13546 1/20 0.39
PARP1 P09874 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
TACR1 P25103 2/20 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
SCHEMBL30595864 0.87 RIPK1 (0.53) NR1H2NR1H3RXRARIPK1GPR119
SCHEMBL8140446 0.86 PARP1 (0.43) NR1H2NR1H3PARP1TACR1
SCHEMBL22285173 0.86 NR1H2 (0.49) NR1H2NR1H3RXRARIPK1PARP1
SCHEMBL4325057 0.86 NR1H2 (0.49) NR1H2NR1H3RXRARIPK1PARP1
SCHEMBL874416 0.86 NR1H2 (0.49) NR1H2NR1H3RXRARIPK1PARP1
SCHEMBL3201139 0.84 NR1H2 (0.44) NR1H2NR1H3RXRARIPK1PARP1
SCHEMBL30910360 0.84 TACR1 (0.39) NR1H2NR1H3RIPK1PARP1TACR1
SCHEMBL21198773 0.83 RIPK1 (0.53) NR1H2NR1H3RIPK1GPR119
SCHEMBL21207072 0.83 RIPK1 (0.53) NR1H2NR1H3RIPK1GPR119
SCHEMBL4718386 0.83 RIPK1 (0.53) NR1H2NR1H3RIPK1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633173-B2 Preparation and uses of 1,2,4-triazolo [1,5a] pyridine derivatives CEPHALON, INC (US) 2014-01-21 US disclosed
US-20130296312-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CEPHALON, INC. 2013-11-07 US disclosed
US-8501936-B2 Preparation and uses of 1,2,4-triazolo [1,5a] pyridine derivatives CEPHALON, INC. (US) 2013-08-06 US disclosed
CN-102459258-A Preparation and use of 1,2, 4-triazolo [1,5a ] pyridine derivatives CEPHALON INC 2012-05-16 CN disclosed
EP-2438066-A2 PREPARATION AND USES OF 1,2,4-TRIAZOLO [1,5a]PYRIDINE DERIVATIVES Cephalon, Inc. (US) 2012-04-11 EP disclosed
US-20100311693-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CEPHALON, INC. (US) 2010-12-09 US disclosed
WO-2010141796-A2 PREPARATION AND USES OF 1,2,4-TRIAZOLO [1,5a] PYRIDINE DERIVATIVES CEPHALON, INC. (US) 2010-12-09 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-20130296312-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives JAK2, JAK1, JAK3 NR1H2 2592/4885NR1H3 2699/4885RXRA 615/4885
US-20100311693-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CCNA1, CCNY, RB1 NR1H2 2009/4885NR1H3 1896/4885RXRA 213/4885

“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.