SCHEMBL7034848

SCHEMBL7034848

CC(C)(C)OC(=O)N1CCOC(c2ccc(F)cc2F)C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
GPR119 Q8TDV5 3/20 0.43
GRIN2B Q13224 1/20 0.41
USP2 O75604 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
USP30 Q70CQ3 1/20 0.41
MAPT P10636 2/20 0.41
MC4R P32245 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
LMNA P02545 1/20 0.40
P2RX7 Q99572 1/20 0.40
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL12609869 0.89 NR1H2 (0.46) SMN1; SMN2GPR119USP2USP30HDAC1
SCHEMBL30382351 0.89 USP30 (0.50) SMN1; SMN2GPR119USP2USP30
SCHEMBL14150500 0.89 NR1H2 (0.46) SMN1; SMN2GPR119USP2USP30HDAC1
SCHEMBL12609675 0.89 USP30 (0.50) SMN1; SMN2GPR119USP2USP30
SCHEMBL12609945 0.89 USP30 (0.50) SMN1; SMN2GPR119USP2USP30
SCHEMBL12609677 0.89 USP30 (0.50) SMN1; SMN2GPR119USP2USP30
SCHEMBL12609865 0.89 NR1H2 (0.46) SMN1; SMN2GPR119USP2USP30HDAC1
SCHEMBL25178046 0.84 GPR119 (0.45) SMN1; SMN2GPR119GRIN2BUSP2USP30
SCHEMBL31116762 0.84 GPR119 (0.45) SMN1; SMN2GPR119GRIN2BUSP2USP30
SCHEMBL30373982 0.83 RORC (0.44) SMN1; SMN2GRIN2BUSP2MEN1KMT2A

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
EP-2661435-B1 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS JANSSEN PHARMACEUTICALS INC (US) 2015-08-19 EP disclosed
US-8993591-B2 1,2,4-triazolo[4,3-a] pyridine derivatives and their use as positive allosteric modulators of MGLUR2 receptors Janssen Pharmaceuticals, Inc. (US) 2015-03-31 US disclosed
US-8993591-B2 1,2,4-triazolo[4,3-a] pyridine derivatives and their use as positive allosteric modulators of MGLUR2 receptors Janssen Pharmaceuticals, Inc. (US) 2015-03-31 US disclosed
US-20140155393-A1 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS Janssen Pharmaceuticals, Inc. (US) 2014-06-05 US disclosed
US-20140155393-A1 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS Janssen Pharmaceuticals, Inc. (US) 2014-06-05 US disclosed
WO-2012062759-A1 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS Janssen Pharmaceuticals, Inc. (US) 2012-05-18 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 (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-20140155393-A1 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS GRM2, GRM1, GRM3 SMN1; SMN2 1355/4885GPR119 52/4885GRIN2B 14/4885

“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.