SCHEMBL19687800

SCHEMBL19687800

CC(=O)OC1CCCCCCCC(C)(C)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.47
EPHX1 P07099 2/20 0.42
NAAA Q02083 2/20 0.39
HTT P42858 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPT P10636 1/20 0.36
CYP3A4 P08684 2/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP2C9 P11712 1/20 0.34
HSD11B1 P28845 1/20 0.34
CYP19A1 P11511 2/20 0.34

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
SCHEMBL15958790 1.00 CYP2C19 (0.47) CYP2C19EPHX1NAAAHTTALDH1A1
SCHEMBL15704501 1.00 CYP2C19 (0.47) CYP2C19EPHX1NAAAHTTALDH1A1
SCHEMBL15427312 1.00 CYP2C19 (0.47) CYP2C19EPHX1NAAAHTTALDH1A1
SCHEMBL14887383 1.00 CYP2C19 (0.47) CYP2C19EPHX1NAAAHTTALDH1A1
SCHEMBL23506964 0.85 EPHX1 (0.52) CYP2C19EPHX1NAAAHTTCA12
SCHEMBL19063411 0.85 EPHX1 (0.52) CYP2C19EPHX1NAAAHTTCA12
SCHEMBL93396 0.85 EPHX1 (0.52) CYP2C19EPHX1NAAAHTTCA12
SCHEMBL22540554 0.85 EPHX1 (0.52) CYP2C19EPHX1NAAAHTTCA12
SCHEMBL23018499 0.85 EPHX1 (0.52) CYP2C19EPHX1NAAAHTTCA12
SCHEMBL200090 0.85 EPHX1 (0.52) CYP2C19EPHX1NAAAHTTCA12

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-20170348424-A1 PROTEIN-POLYMER-DRUG CONJUGATES MERSANA THERAPEUTICS, INC. 2017-12-07 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-20170348424-A1 PROTEIN-POLYMER-DRUG CONJUGATES PBRM1, CLTB, BRAP CYP2C19 4620/4885EPHX1 4311/4885NAAA 3420/4885

“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.