SCHEMBL5844286

SCHEMBL5844286

CNCc1ccc(CC(=O)OC)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.61
CYP4A11 Q02928 1/20 0.61
HPGD P15428 1/20 0.51
ALDH1A1 P00352 5/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
GAA P10253 1/20 0.50
GFER P55789 1/20 0.50
MEN1 O00255 1/20 0.50
HSP90AB1 P08238 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
TP53 P04637 2/20 0.46
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL4113212 0.87 CYP4F2 (0.76) CYP4F2CYP4A11HPGDALDH1A1MAPT
SCHEMBL28449977 0.83 MAPT (0.60) CYP4F2CYP4A11ALDH1A1MAPTKMT2A
SCHEMBL12028692 0.82 SLC7A5 (0.57) CYP4F2CYP4A11HPGDALDH1A1MAPT
SCHEMBL2286242 0.80 CYP4F2 (0.61) CYP4F2CYP4A11HPGDALDH1A1MAPT
SCHEMBL4765884 0.79 CYP4F2 (0.56) CYP4F2CYP4A11HPGDALDH1A1MAPT
SCHEMBL4765888 0.79 CYP4F2 (0.56) CYP4F2CYP4A11HPGDALDH1A1MAPT
SCHEMBL16090748 0.79 CYP4F2 (0.56) CYP4F2CYP4A11HPGDALDH1A1MAPT
SCHEMBL11076678 0.79 POLB (0.48) ALDH1A1MAPTKMT2AMEN1NPC1
SCHEMBL10065854 0.79 CA2 (0.56) HPGDALDH1A1MAPTKMT2AGAA
SCHEMBL112488 0.79 CYP4F2 (0.66) CYP4F2CYP4A11ALDH1A1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014144610-A1 LACTAM COMPOUNDS AS EP4 RECEPTOR-SELECTIVE AGONISTS FOR USE IN THE TREATMENT OF EP4-MEDIATED DISEASES AND CONDITIONS CAYMAN CHEMICAL COMPANY, INC. (US) 2014-09-18 WO disclosed
US-7569602-B2 Furan derivatives as EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2009-08-04 US disclosed
US-7528140-B2 Substituted pyrrolo[3,2-d]pyrimidines as glycogen synthase kinase (GSK) inhibitors TEIJIN LIMITED (JP) 2009-05-05 US disclosed
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2008-12-11 US disclosed
US-7417068-B2 EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2008-08-26 US disclosed
US-20070135503-A1 Furan derivatives as ep4 receptor antagonists ASTERAND UK ACQUISITION LIMITED (GB) 2007-06-14 US disclosed
US-6992193-B2 Sulfonylamino phenylacetamide derivatives and methods of their use ADOLOR CORPORATION (US) 2006-01-31 US disclosed
WO-2005004796-A2 SULFONYLAMINO PHENYLACETAMIDE DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2005-01-20 WO disclosed
US-20040254156-A1 Sulfonylamino phenylacetamide derivatives and methods of their use CALIXA THERAPEUTICS, INC. 2004-12-16 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 (3 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-20040254156-A1 Sulfonylamino phenylacetamide derivatives and methods of their use CYP2E1, CYP2D6, CYP3A43 CYP4F2 44/4885CYP4A11 49/4885HPGD 528/4885
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER3, NR4A3 CYP4F2 1009/4885CYP4A11 395/4885HPGD 1200/4885
US-20070135503-A1 Furan derivatives as ep4 receptor antagonists PTGER4, PTGER3, NR4A3 CYP4F2 602/4885CYP4A11 384/4885HPGD 1216/4885

“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.