SCHEMBL13737409

SCHEMBL13737409

COC[C@@H](C)Oc1cccc2ccc(C)nc12

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.72
DHFR P00374 2/20 0.48
DCPS Q96C86 2/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
BDKRB2 P30411 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
SCHEMBL13737410 1.00 MCHR1 (0.72) MCHR1DHFRDCPSKDM4ELMNA
SCHEMBL13739679 0.87 MCHR1 (0.55) MCHR1KDM4ELMNAHTTMEN1
SCHEMBL5884451 0.84 MCHR1 (1.00) MCHR1
SCHEMBL15398749 0.81 MCHR1 (0.53) MCHR1KDM4ELMNAHTTMEN1
SCHEMBL15398746 0.81 MCHR1 (0.53) MCHR1KDM4ELMNAHTTMEN1
SCHEMBL15400315 0.81 MCHR1 (0.49) MCHR1DHFRDCPSKDM4ELMNA
SCHEMBL15399476 0.81 MCHR1 (0.49) MCHR1DHFRDCPSKDM4ELMNA
SCHEMBL15400314 0.81 MCHR1 (0.49) MCHR1DHFRDCPSKDM4ELMNA
SCHEMBL15399473 0.81 MCHR1 (0.49) MCHR1DHFRDCPSKDM4ELMNA
SCHEMBL17641054 0.81 MCHR1 (0.68) MCHR1KDM4ELMNAHTTMEN1

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
EP-2678329-B1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-11-18 EP disclosed
US-8889704-B2 Triazolopyridine compounds as PIM kinase inhibitors ARRAY BIOPHARMA INC. (US) 2014-11-18 US disclosed
US-20140005213-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2014-01-02 US disclosed
EP-2678329-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS Array Biopharma, Inc. (US) 2014-01-01 EP disclosed
WO-2012154274-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-11-15 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-20140005213-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS PIM1, PIM2, PIM3 MCHR1 1613/4885DHFR 2767/4885DCPS 3384/4885

“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.