SCHEMBL18586099

SCHEMBL18586099

Nc1cc(Cn2nnc3cccc(Cl)c32)c2nn[nH]c2n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 1/20 0.38
▸ LMNA P02545 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ TP53 P04637 2/20 0.34
▸ PRMT5 O14744 1/20 0.33
▸ HPGD P15428 4/20 0.32
▸ GAA P10253 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ MPO P05164 3/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ PTK2 Q05397 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL20672132 0.83 GRM2 (0.43) SLC9A1LMNAKMT2AMEN1TP53
SCHEMBL18586034 0.82 LMNA (0.48) SLC9A1LMNATDP1KMT2ATP53
SCHEMBL18616566 0.81 SLC9A1 (0.44) SLC9A1LMNATDP1KMT2ATP53
SCHEMBL18586233 0.81 SLC9A1 (0.44) SLC9A1LMNATDP1KMT2ATP53
SCHEMBL18585766 0.80 MPO (0.33) MPO
SCHEMBL18616670 0.75 SLC9A1 (0.39) SLC9A1LMNATDP1KMT2AMEN1
SCHEMBL18585592 0.74 PIK3CG (0.34) MPOMAPTSMN1; SMN2
SCHEMBL18586454 0.73 HCAR3 (0.39) SLC9A1LMNATDP1KMT2ATP53
SCHEMBL18585842 0.73 GRM2 (0.38) SLC9A1LMNATDP1KMT2ATP53
SCHEMBL18621241 0.73 MPO (0.59) KMT2AMEN1MPOSMN1; SMN2

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
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-10 — — US disclosed
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
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
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 SLC9A1 1353/4885LMNA 4544/4885TDP1 790/4885
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 SLC9A1 1353/4885LMNA 4544/4885TDP1 790/4885

“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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