SCHEMBL12019248

SCHEMBL12019248

CCOC(=O)c1cccc(OC2CCc3ccccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.51
GFRA2 O00451 1/20 0.48
GFRA3 O60609 1/20 0.48
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
DRD3 P35462 1/20 0.43
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.42
CDC25B P30305 1/20 0.41
F10 P00742 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL12019229 0.87 FFAR1 (0.59) FFAR1MEN1KMT2ADRD3MAPT
SCHEMBL12019230 0.80 FFAR1 (0.61) FFAR1MEN1KMT2APOLB
SCHEMBL1513399 0.80 FFAR1 (0.45) FFAR1MEN1KMT2AMAPT
SCHEMBL12017998 0.79 FFAR1 (0.47) FFAR1GFRA2GFRA3KMT2A
SCHEMBL1746725 0.78 GFRA3 (0.50) FFAR1GFRA2GFRA3MAPTPOLB
SCHEMBL11343724 0.78 KMT2A (0.49) MEN1KMT2APOLBATM
SCHEMBL24470813 0.78 PTGS2 (0.61) FFAR1MAPTPOLB
SCHEMBL29713112 0.78 PTGS2 (0.61) FFAR1MAPTPOLB
SCHEMBL931742 0.76 MAOA (0.52) MEN1KMT2AATMOPRK1
SCHEMBL930973 0.76 MAOA (0.49) MEN1KMT2AMAPTATMF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120220772-A1 NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2012-08-30 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-20120220772-A1 NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE GPR119, GPR27, NR0B1 FFAR1 39/4885GFRA2 748/4885GFRA3 714/4885

“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.