SCHEMBL20658792

SCHEMBL20658792

O=C(O)N1CCC(Cc2cccc(CO)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 1/20 0.51
RAB9A P51151 1/20 0.50
CYP2C9 P11712 3/20 0.49
CYP2C19 P33261 3/20 0.49
MAPK14 Q16539 3/20 0.49
HTR2B P41595 2/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
TACR3 P29371 1/20 0.49

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
SCHEMBL28246648 0.84 MEN1 (0.52) FAAHMEN1KMT2AALDH1A1RAB9A
SCHEMBL2636547 0.84 MEN1 (0.68) FAAHMEN1KMT2AALDH1A1RAB9A
SCHEMBL1867074 0.84 CCR3 (0.52) FAAHMEN1KMT2ACYP2C9CYP2C19
SCHEMBL27803883 0.84 TACR3 (0.51) FAAHMEN1KMT2ACYP2C9CYP2C19
SCHEMBL19873074 0.84 MEN1 (0.61) FAAHMEN1KMT2AALDH1A1CYP2C9
SCHEMBL23365213 0.84 CYP2C9 (0.54) FAAHMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1364179 0.81 FAAH (0.47) FAAHMEN1KMT2ACYP2C9CYP2C19
SCHEMBL6397917 0.81 MGLL (0.66) FAAH
SCHEMBL2933305 0.81 CYP2C9 (0.54) MEN1KMT2ACYP2C9CYP2C19MAPK14
SCHEMBL758717 0.81 ENPP2 (0.44) ALDH1A1GAA

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-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

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 FAAH 550/4885MEN1 4641/4885KMT2A 2066/4885
US-10407422-B2 Triazolopyridine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 FAAH 550/4885MEN1 4641/4885KMT2A 2066/4885

“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.