SCHEMBL18616337

SCHEMBL18616337

O=Cc1cnn(Cc2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
PSD A5PKW4 1/20 0.48
CREBBP Q92793 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
HDAC2 Q92769 1/20 0.44
EPHB4 P54760 2/20 0.44
KDR P35968 2/20 0.44
TEK Q02763 2/20 0.44
HSP90AB1 P08238 2/20 0.43
HSD17B10 Q99714 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
CYP17A1 P05093 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL1244985 0.91 L3MBTL1 (0.57) L3MBTL1PSDCREBBPSMN1; SMN2NPC1
SCHEMBL20658807 0.87 L3MBTL1 (0.55) L3MBTL1PSDCREBBPSMN1; SMN2HDAC2
SCHEMBL17591714 0.83 HSD17B10 (0.49) L3MBTL1PSDSMN1; SMN2LMNAMAPT
SCHEMBL4769322 0.81 SMN1; SMN2 (0.51) L3MBTL1PSDSMN1; SMN2NPC1RAB9A
SCHEMBL30755398 0.81 LMNA (0.58) PSDCREBBPSMN1; SMN2NPC1RAB9A
SCHEMBL20658827 0.81 HSD17B10 (0.67) L3MBTL1PSDSMN1; SMN2LMNAMAPT
SCHEMBL18586165 0.79 VDR (0.48) PSDRAB9AHSP90AB1
SCHEMBL17094867 0.78 L3MBTL1 (0.50) L3MBTL1NPC1RAB9AMAPTHSP90AB1
SCHEMBL18235823 0.78 KMT2A (0.62) L3MBTL1PSDSMN1; SMN2NPC1RAB9A
SCHEMBL17095073 0.77 CYP3A4 (0.60) PSDLMNAMAPTHDAC2HSD17B10

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 L3MBTL1 4794/4885PSD 3739/4885CREBBP 1663/4885
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 L3MBTL1 4794/4885PSD 3739/4885CREBBP 1663/4885

“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.