SCHEMBL18616585

SCHEMBL18616585

OCc1cccc(OCC2CCc3ccccc32)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 5/20 0.44
▸ HTR6 P50406 1/20 0.42
▸ PRMT5 O14744 3/20 0.41
▸ WDR77 Q9BQA1 3/20 0.41
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ GPBAR1 Q8TDU6 1/20 0.40
▸ CYSLTR1 Q9Y271 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ FFAR1 O14842 1/20 0.38
▸ CYP4F2 P78329 1/20 0.38
▸ CYP4A11 Q02928 1/20 0.38

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
SCHEMBL18618135 0.87 PPARD (0.48) PPARDHTR6PRMT5WDR77
SCHEMBL18617329 0.87 PPARD (0.44) PPARDHTR6PRMT5WDR77SMN1; SMN2
SCHEMBL20672040 0.84 HTR6 (0.42) PPARDHTR6PRMT5WDR77FFAR1
SCHEMBL27641091 0.81 PPARD (0.51) PPARDCYSLTR1SMN1; SMN2FFAR1
SCHEMBL1744666 0.78 GFRA3 (0.53) PRMT5WDR77FFAR1
SCHEMBL6241502 0.75 KDM5A (0.48) PPARDGPBAR1CYSLTR1TSHRSMN1; SMN2
SCHEMBL16902898 0.75 KDM5A (0.48) PPARDGPBAR1CYSLTR1TSHRSMN1; SMN2
SCHEMBL18617533 0.74 PPARD (0.47) PPARDTSHRSMN1; SMN2
SCHEMBL20671959 0.72 S1PR1 (0.44) PPARDHTR6
SCHEMBL31220919 0.72 TLR4 (0.50) —

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
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

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 PPARD 575/4885HTR6 3077/4885PRMT5 875/4885
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 PPARD 575/4885HTR6 3077/4885PRMT5 875/4885

“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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