SCHEMBL787792

SCHEMBL787792

CCCCC(C(=O)O)P(=O)(OC)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.44
MAPK1 P28482 1/20 0.44
FDPS P14324 2/20 0.41
CA1 P00915 1/20 0.40
GPR84 Q9NQS5 3/20 0.38
FFAR1 O14842 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.37
LCK P06239 1/20 0.37
PPARD Q03181 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
CHRM1 P11229 1/20 0.35
AKR1A1 P14550 1/20 0.35
CHRM3 P20309 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35

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
SCHEMBL3899260 0.88 CHRM1 (0.43) CA2MAPK1FDPSGPR84SLC1A3
SCHEMBL1903133 0.83 CA2 (0.42) CA2MAPK1FDPSCA1GPR84
SCHEMBL8383656 0.81 FDPS (0.42) CA2MAPK1FDPSGPR84FFAR1
SCHEMBL9184149 0.80 FOLH1 (0.36) LMNA
SCHEMBL6579012 0.79 LMNA (0.38) CA2MAPK1CA1SLC1A3SLC1A2
SCHEMBL9181835 0.78 FOLH1 (0.59) SLC1A3SLC1A2SLC1A1
SCHEMBL3232568 0.78 FOLH1 (0.57) CA2MAPK1FDPSGPR84FFAR1
SCHEMBL2991458 0.78 FDPS (0.50) CA2MAPK1FDPSGPR84FFAR1
SCHEMBL10930276 0.77 LAP3 (0.44) CA2FDPSCA1GPR84SMPD1
SCHEMBL13924959 0.77 GPR84 (0.47) FDPSGPR84FFAR1MAPTLCK

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 CA2 3198/4885MAPK1 3840/4885FDPS 42/4885

“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.