SCHEMBL5457635

SCHEMBL5457635

CC(C)(C)OC(=O)/C=C/c1ccccc1/C=C/C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
NFKB1 P19838 1/20 0.51
CA4 P22748 1/20 0.51
HTT P42858 2/20 0.49
LMNA P02545 2/20 0.49
NR1I2 O75469 1/20 0.49
PGR P06401 1/20 0.49
CYP3A4 P08684 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
CYP2C9 P11712 1/20 0.49
SLC6A2 P23975 1/20 0.49
TBXAS1 P24557 1/20 0.49
CYP2C19 P33261 1/20 0.49
DRD3 P35462 1/20 0.49
OPRK1 P41145 1/20 0.49
PDE4D Q08499 1/20 0.49
KCNH2 Q12809 1/20 0.49
PTGER3 P43115 4/20 0.47
PTGER2 P43116 4/20 0.47

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
SCHEMBL5457639 1.00 CA1 (0.51) CA1CA2NFKB1CA4HTT
SCHEMBL5474595 0.93 LMNA (0.53) CA1CA2NFKB1CA4HTT
SCHEMBL5474591 0.93 LMNA (0.53) CA1CA2NFKB1CA4HTT
SCHEMBL5468478 0.87 LMNA (0.49) NFKB1HTTLMNANR1I2PGR
SCHEMBL5468473 0.87 LMNA (0.49) NFKB1HTTLMNANR1I2PGR
SCHEMBL29262006 0.87 LMNA (0.49) NFKB1HTTLMNANR1I2PGR
SCHEMBL29607568 0.84 LMNA (0.47) HTTLMNANR1I2PGRCYP3A4
SCHEMBL6807798 0.84 LMNA (0.47) HTTLMNANR1I2PGRCYP3A4
SCHEMBL6807802 0.84 LMNA (0.47) HTTLMNANR1I2PGRCYP3A4
SCHEMBL11833868 0.83 MAPT (0.59) CA1CA2NFKB1CA4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043088-A1 PROCESS FOR PREPARING LACIDIPINE DR. REDDY'S LABORATORIES LIMITED (IN) 2007-02-22 US 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-20070043088-A1 PROCESS FOR PREPARING LACIDIPINE CHRNA5, CACNA1I, CHRNA3 CA1 280/4885CA2 368/4885NFKB1 1223/4885

“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.