SCHEMBL1965468

SCHEMBL1965468

O=C(OC1CCN(C(=O)OCc2ccccc2)CC1F)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
CYP2C19 P33261 1/20 0.53
USP30 Q70CQ3 1/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
GRIN2B Q13224 2/20 0.46
HTT P42858 1/20 0.46
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL1965469 1.00 SMN1; SMN2 (0.55) SMN1; SMN2RAB9ANPC1CYP2C19USP30
SCHEMBL19023251 0.90 BCHE (0.49) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL19037343 0.90 BCHE (0.49) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL19023252 0.90 BCHE (0.49) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL19023253 0.90 BCHE (0.49) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL13449383 0.90 BCHE (0.49) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL19015604 0.86 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL13162568 0.86 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL13162565 0.86 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1CYP2C19KMT2A
SCHEMBL6119752 0.84 MEN1 (0.46) CYP2C19KMT2AMEN1CYP2C9

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-8987251-B2 Triazolopyridine compounds as PIM kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-03-24 US disclosed
US-20140045817-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2014-02-13 US disclosed
US-8575145-B2 Triazolopyridine compounds as PIM kinase inhibitors ARRAY BIOPHARMA INC. (US) 2013-11-05 US disclosed
EP-2334677-B1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2013-10-09 EP disclosed
EP-2334677-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS Array Biopharma, Inc. (US) 2011-06-22 EP disclosed
US-20110144085-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-06-16 US disclosed
WO-2010022076-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-02-25 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-20110144085-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS PIM1, PIM2, PIM3 SMN1; SMN2 4457/4885RAB9A 2050/4885NPC1 4398/4885
US-20140045817-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS PIM2, PIM1, PIM3 SMN1; SMN2 3338/4885RAB9A 2978/4885NPC1 3735/4885

“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.