SCHEMBL18618941

SCHEMBL18618941

Nc1cc(Cc2cccc(Cl)c2)c2nn[nH]c2n1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 13/20 0.60
▸ PNP P00491 1/20 0.45
▸ TPO P07202 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ EPX P11678 1/20 0.41
▸ YTHDF3 Q7Z739 2/20 0.41
▸ YTHDC1 Q96MU7 2/20 0.41
▸ YTHDF1 Q9BYJ9 2/20 0.41
▸ YTHDF2 Q9Y5A9 2/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ADCY10 Q96PN6 1/20 0.40

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
SCHEMBL18620306 0.86 MPO (0.60) MPOTPOCYP3A4EPX
SCHEMBL18586508 0.85 MPO (0.56) MPOTPOCYP3A4EPX
SCHEMBL18617439 0.85 MPO (0.56) MPOTPOCYP3A4EPX
SCHEMBL18620070 0.85 MPO (0.60) MPOTPOCYP3A4EPX
SCHEMBL20515409 0.85 MPO (0.60) MPOTPOCYP3A4EPX
SCHEMBL18586829 0.84 MPO (0.61) MPOTPOCYP3A4EPX
SCHEMBL18618879 0.82 MPO (0.60) MPOTPOCYP3A4EPX
SCHEMBL20515417 0.81 MPO (0.63) MPOTPOCYP3A4EPX
SCHEMBL20515420 0.81 MPO (0.63) MPOTPOCYP3A4EPX
SCHEMBL19381116 0.81 DHFR (0.50) MPOADCY10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180282320-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL MYERS SQUIBB CO (US) 2018-10-04 — — US disclosed
WO-2017040451-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 (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-20180282320-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE EPX, MPO, SERPINB1 MPO 2/4885PNP 227/4885TPO 7/4885

“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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