SCHEMBL4089382

SCHEMBL4089382

CSc1ccc(C(O)c2ccccc2C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.41
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
SCD O00767 1/20 0.36
FAAH O00519 2/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 1/20 0.35
CNR2 P34972 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SLC6A4 P31645 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
P2RX7 Q99572 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TOP2A P11388 1/20 0.34
TOP2B Q02880 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34

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
SCHEMBL4075729 0.82 ACP3 (0.44) ACP3SCDADORA2AADORA1CNR2
SCHEMBL3289370 0.81 ACP3 (0.57) ACP3SCDADORA2AADORA1CNR2
SCHEMBL30986703 0.81 ACP3 (0.57) ACP3SCDADORA2AADORA1CNR2
SCHEMBL3294921 0.81 ACP3 (0.57) ACP3SCDADORA2AADORA1CNR2
SCHEMBL4083661 0.80 ACP3 (0.45) ACP3SCDADORA2AADORA1CNR2
SCHEMBL4189236 0.79 CNR2 (0.49) ACP3SCDADORA2AADORA1CNR2
SCHEMBL4080242 0.78 KMT2A (0.46) ACP3SCDMEN1KMT2AMAPT
SCHEMBL30903830 0.77 ACP3 (0.50) ACP3CNR2P2RX7OPRM1OPRD1
SCHEMBL9776265 0.77 ACP3 (0.50) ACP3CNR2P2RX7OPRM1OPRD1
SCHEMBL4075644 0.76 RORC (0.43) ACP3ADORA2AADORA1MEN1KMT2A

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
EP-1620395-B1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RES LTD (GB) 2009-12-30 EP disclosed
US-7504522-B2 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disorders VERNALIS RESEARCH LIMITED (GB) 2009-03-17 US disclosed
US-20070054891-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disorders VERNALIS RESEARCH LIMAITED (GB) 2007-03-08 US disclosed
EP-1620395-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RESEARCH LIMITED (GB) 2006-02-01 EP disclosed
WO-2004096763-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RESEARCH LIMITED (GB) 2004-11-11 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 (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-20070054891-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disorders CNR1, CNR2, GPR119 ACP3 4050/4885STK10 4445/4885SLK 4110/4885

“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.