SCHEMBL18617784

SCHEMBL18617784

Nc1cc(CC2CCCCCCC2)c2nn[nH]c2n1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 1/20 0.40
▸ CDK2 P24941 2/20 0.34
▸ FEN1 P39748 1/20 0.33
▸ JAK2 O60674 2/20 0.33
▸ JAK1 P23458 1/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ HTR3A P46098 1/20 0.32
▸ HRH4 Q9H3N8 1/20 0.32
▸ ROCK2 O75116 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ BACE1 P56817 1/20 0.31
▸ PDE9A O76083 1/20 0.31
▸ MCHR1 Q99705 1/20 0.31
▸ APP P05067 1/20 0.31
▸ CDC7 O00311 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ DAO P14920 1/20 0.31

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
SCHEMBL18618906 1.00 PNP (0.40) PNPCDK2FEN1JAK2JAK1
SCHEMBL18617524 1.00 PNP (0.40) PNPCDK2FEN1JAK2JAK1
SCHEMBL18617484 1.00 PNP (0.40) PNPCDK2FEN1JAK2JAK1
SCHEMBL19295486 0.77 CDK2 (0.54) CDK2MCHR1
SCHEMBL18620064 0.77 CDK2 (0.54) CDK2MCHR1
SCHEMBL19295485 0.77 CDK2 (0.54) CDK2MCHR1
SCHEMBL18586225 0.76 MPO (0.44) HRH4
SCHEMBL18617538 0.74 NOS3 (0.34) —
SCHEMBL22423835 0.74 MPO (0.31) CDK2MCHR1
SCHEMBL18585833 0.71 MPO (0.62) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-10 — — US disclosed
US-20190023701-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL MYERS SQUIBB CO (US) 2019-01-24 — — US disclosed
WO-2017040449-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MYERS SQUIBB COMPANY (US) 2017-03-09 — — 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-20190023701-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE EPX, MPO, SERPINB1 PNP 227/4885CDK2 3311/4885FEN1 1003/4885
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 PNP 227/4885CDK2 3311/4885FEN1 1003/4885

“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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