SCHEMBL4327201

SCHEMBL4327201

COC1CC(C(=O)O)(C(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.33
APLNR P35414 1/20 0.32
FFAR3 O14843 1/20 0.31
GRM4 Q14833 4/20 0.30
ALDH1A1 P00352 2/20 0.30
CYP1A2 P05177 2/20 0.30
CYP2C19 P33261 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
GRM8 O00222 1/20 0.30
GRM6 O15303 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALOX15 P16050 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
SCHEMBL32676486 0.80 SMN1; SMN2 (0.34) ALDH1A1MEN1KMT2AKDM4EALOX15
SCHEMBL25554207 0.78 FFAR3 (0.46) EPHX2APLNRFFAR3CYP2C19
SCHEMBL31268179 0.78 EPHX2 (0.32) EPHX2APLNR
SCHEMBL16577977 0.76 DPP4 (0.37) EPHX2FFAR3CYP2C19
SCHEMBL15257506 0.76 GRM4 (0.52) GRM4ALDH1A1CYP1A2CYP2C19MEN1
SCHEMBL28317777 0.75 ALDH1A1 (0.31) ALDH1A1MEN1KMT2AKDM4EALOX15
SCHEMBL6908370 0.72 POLB (0.36) EPHX2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL28964132 0.70 GRM4 (0.33) APLNRGRM4ALDH1A1CYP1A2CYP2C19
SCHEMBL1661518 0.70 APLNR (0.36) APLNRFFAR3GRM4ALDH1A1CYP1A2
Acetic Acid SCHEMBL987785 0.69 GAA (0.49) ALDH1A1MEN1KMT2AKDM4EALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7566781-B2 Imidazopyridine compound BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-07-28 US disclosed
US-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide BANYU PHARMACEUTICAL., LTD. (JP) 2007-10-25 US disclosed
EP-1748048-A1 IMIDAZOPYRIDINE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-31 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-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide MC1R, MCHR2, MCHR1 EPHX2 2044/4885APLNR 551/4885FFAR3 170/4885

“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.