SCHEMBL1508640

SCHEMBL1508640

CCO[C@@](C)(CC(=O)O)c1ccc(OC2Cc3ccccc3C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.54
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
LNPEP Q9UIQ6 1/20 0.36
CHRM3 P20309 5/20 0.35
CHRM2 P08172 4/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NAMPT P43490 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ADRB2 P07550 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL1508581 0.75 FFAR1 (0.38) FFAR1
SCHEMBL1508433 0.73 ESR1 (0.47) CYP2C19HIF1ACHRM3CHRM2SMN1; SMN2
SCHEMBL1508424 0.72 FFAR1 (0.60) FFAR1
SCHEMBL1508599 0.71 FFAR1 (0.60) FFAR1
SCHEMBL1508332 0.71 PREP (0.39) CYP2C19HIF1ASMN1; SMN2MAPT
SCHEMBL3497927 0.71 FFAR1 (0.55) FFAR1HSD17B10ADRB2
SCHEMBL11287323 0.71 FFAR1 (0.50) FFAR1LNPEPCHRM3CHRM2PDE4A
SCHEMBL1508276 0.71 FFAR1 (0.61) FFAR1MEN1KMT2A
SCHEMBL12019231 0.70 FFAR1 (0.55) FFAR1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL1508473 0.70 FFAR1 (0.63) FFAR1

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-20110053974-A1 CARBOXYLIC ACID COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-03 US disclosed
EP-2289868-A1 CARBOXYLIC ACID COMPOUND Daiichi Sankyo Company, Limited (JP) 2011-03-02 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-20110053974-A1 CARBOXYLIC ACID COMPOUND AKR1C3, SLC5A1, GPR119 FFAR1 219/4885CYP2C19 1003/4885HIF1A 865/4885

“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.