SCHEMBL18616620

SCHEMBL18616620

CCOC(=O)c1cccc(C2CCN(C(=O)OC(C)(C)C)C(C)C2)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
FDFT1 P37268 1/20 0.40
ATM Q13315 1/20 0.39
ALDH1A1 P00352 4/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
NPY2R P49146 1/20 0.37
ALOX5 P09917 1/20 0.37

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
SCHEMBL14636211 0.89 MEN1 (0.42) MEN1KMT2ATP53POLBFDFT1
SCHEMBL20658797 0.86 FDFT1 (0.44) TP53FDFT1ATMALDH1A1TSHR
SCHEMBL1274282 0.84 TP53 (0.55) MEN1KMT2ATP53POLBATM
SCHEMBL14636212 0.82 ATM (0.41) FDFT1ATMALDH1A1TSHRNPY2R
SCHEMBL18617696 0.81 DRD2 (0.42) GAASMN1; SMN2NPSR1GPR119
SCHEMBL21537509 0.81 KMT2A (0.42) MEN1KMT2ATP53POLBATM
SCHEMBL18245002 0.81 TP53 (0.45) MEN1KMT2ATP53POLBFDFT1
SCHEMBL3163819 0.81 TP53 (0.45) MEN1KMT2ATP53POLBFDFT1
SCHEMBL24700140 0.80 NAMPT (0.46) TP53LMNAKDM4EGPR119
SCHEMBL20672072 0.80 TP53 (0.45) MEN1KMT2ATP53POLBATM

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 MEN1 4641/4885KMT2A 2066/4885TP53 4759/4885
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 MEN1 4641/4885KMT2A 2066/4885TP53 4759/4885

“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.