SCHEMBL5210936

SCHEMBL5210936

NC(=O)c1ncc(C(=O)c2ccccc2)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.48
FAAH O00519 3/20 0.48
NPC1 O15118 4/20 0.46
RAB9A P51151 3/20 0.46
KMT2A Q03164 3/20 0.46
TSHR P16473 2/20 0.46
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46
VNN1 O95497 3/20 0.44
MAPT P10636 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP2C19 P33261 2/20 0.44
HSD17B10 Q99714 2/20 0.44
POLB P06746 1/20 0.44
CYP3A4 P08684 1/20 0.44
PARP1 P09874 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44

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
SCHEMBL5217327 0.84 NPC1 (0.47) CES1FAAHNPC1RAB9ATSHR
SCHEMBL5213532 0.83 PARP1 (0.54) NPC1RAB9AKMT2AMEN1MAPK1
SCHEMBL5211059 0.79 NPC1 (0.49) NPC1RAB9AKMT2ATSHRMEN1
SCHEMBL5211138 0.78 CES1 (0.47) CES1FAAHTSHRALDH1A1KDM4E
SCHEMBL5215292 0.73 FAAH (0.47) CES1FAAHKMT2ATSHRMEN1
SCHEMBL23337181 0.72 KLKB1 (0.50) CES1FAAH
SCHEMBL6281721 0.69 ALDH1A1 (0.62) CES1NPC1RAB9AKMT2ATSHR
SCHEMBL1109767 0.69 FAAH (0.51) FAAHNPC1RAB9AKMT2AMEN1
SCHEMBL31343478 0.68 ADCY1 (0.50) CES1FAAHNPC1RAB9AKMT2A
SCHEMBL30301340 0.68 TUBB4A (0.55) CES1FAAHNPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1653952-A4 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2007-04-04 EP claimed
US-7112599-B2 Oxazole compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2006-09-26 US claimed
EP-1653952-A2 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Pfizer Products Inc. (US) 2006-05-10 EP claimed
WO-2005016267-A2 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PRODUCTS INC. (US) 2005-02-24 WO claimed
US-20050032859-A1 Oxazole compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2005-02-10 US claimed
EP-1577357-B1 Polishing composition and polishing method FUJIMI INC (JP) 2007-08-29 EP disclosed
EP-1653952-A4 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2007-04-04 EP disclosed
US-7112599-B2 Oxazole compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2006-09-26 US disclosed
EP-1653952-A2 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Pfizer Products Inc. (US) 2006-05-10 EP disclosed
EP-1577357-A1 Polishing composition and polishing method FUJIMI INCORPORATED (JP) 2005-09-21 EP disclosed
WO-2005016267-A2 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PRODUCTS INC. (US) 2005-02-24 WO disclosed
US-20050032859-A1 Oxazole compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2005-02-10 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 (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-20050032859-A1 Oxazole compounds for the treatment of neurodegenerative disorders APP, OXA1L, BACE1 CES1 2298/4885FAAH 3806/4885NPC1 2027/4885

“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.