SCHEMBL3826730

SCHEMBL3826730

CC[C@@H]1CC[C@@H](C(=O)O)N1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.37
ALDH1A1 P00352 1/20 0.35
FFAR2 O15552 3/20 0.33
REN P00797 2/20 0.30
LMNA P02545 2/20 0.30
HSD17B10 Q99714 2/20 0.30
CYP2C19 P33261 1/20 0.30
KDM4E B2RXH2 1/20 0.30
F2 P00734 1/20 0.30
LTA4H P09960 1/20 0.30
MAPT P10636 1/20 0.30
PEPD P12955 1/20 0.30
ALOX15 P16050 1/20 0.30
PTGS1 P23219 1/20 0.30
HTR2A P28223 1/20 0.30
PTGS2 P35354 1/20 0.30
HRH1 P35367 1/20 0.30
THPO P40225 1/20 0.30
PMP22 Q01453 1/20 0.30
ACE2 Q9BYF1 1/20 0.30

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
SCHEMBL22444297 0.85 FFAR2 (0.35) ACEALDH1A1FFAR2
SCHEMBL22371723 0.85 FFAR2 (0.35) ACEALDH1A1FFAR2
SCHEMBL20819892 0.85 FFAR2 (0.35) ACEALDH1A1FFAR2
SCHEMBL28408623 0.85 FFAR2 (0.35) ACEALDH1A1FFAR2
SCHEMBL26622977 0.85 FFAR2 (0.35) ACEALDH1A1FFAR2
SCHEMBL20819885 0.85 FFAR2 (0.35) ACEALDH1A1FFAR2
SCHEMBL3828308 0.82 TP53 (0.36)
SCHEMBL29282054 0.82 POLB (0.35) ACEALDH1A1FFAR2
SCHEMBL2733359 0.81 ACE (0.35) ACEALDH1A1FFAR2
SCHEMBL6034100 0.78 FFAR2 (0.36) ACEALDH1A1FFAR2

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-20090312310-A1 Imidazothiazole derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-12-17 US disclosed
EP-2103619-A1 IMIDAZOTHIAZOLE DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-09-23 EP 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-20090312310-A1 Imidazothiazole derivatives TP53, MDM2, TP53BP1 ACE 2911/4885ALDH1A1 1990/4885FFAR2 4526/4885

“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.