SCHEMBL787793

SCHEMBL787793

CCCCOP(=O)(O)C(C)(C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
LPAR3 Q9UBY5 8/20 0.47
LPAR2 Q9HBW0 6/20 0.47
LPAR1 Q92633 3/20 0.47
FDPS P14324 2/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL3899262 0.88 MEN1 (0.37) CYP3A4LPAR3LPAR2LPAR1FDPS
SCHEMBL4267679 0.87 CYP3A4 (0.47) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL814225 0.85 CYP3A4 (0.48) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL4119345 0.81 LPAR3 (0.48) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL5028839 0.80 CYP3A4 (0.44) CYP3A4LPAR3LPAR2LPAR1FDPS
SCHEMBL6579016 0.79 TSHR (0.40) CYP3A4TSHRALDH1A1
SCHEMBL5028805 0.78 CYP3A4 (0.41) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL8055462 0.77 CYP3A4 (0.48) CYP3A4LPAR3LPAR2LPAR1FDPS
SCHEMBL28395754 0.76 CYP3A4 (0.40) CYP3A4LPAR3LPAR2LPAR1
SCHEMBL16816999 0.76 CYP3A4 (0.52) CYP3A4LPAR3LPAR2LPAR1FDPS

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
WO-2012037258-A1 PROCESSES FOR PREPARING 1,2-SUBSTITUTED CYCLOPROPYL DERIVATIVES ABBOTT LABORATORIES (US) 2012-03-22 WO disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR CYP3A4 1692/4885LPAR3 511/4885LPAR2 903/4885

“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.