SCHEMBL12415463

SCHEMBL12415463

C=CCOC(=O)C1C(C=C)CC(C=C)C1C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
SLC6A2 P23975 1/20 0.34
TSHR P16473 3/20 0.33
TP53 P04637 1/20 0.33
ERN1 O75460 1/20 0.33
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL12415457 0.91 CYP3A4 (0.36) ALDH1A1KMT2ATSHRTP53MAPT
SCHEMBL18432732 0.88 PPM1B (0.37) CYP2C19SLC6A4SLC6A3SLC6A2
SCHEMBL12415460 0.88 PPM1B (0.37) CYP2C19SLC6A4SLC6A3SLC6A2
SCHEMBL5068756 0.81 ALDH1A1 (0.47) CYP19A1ALDH1A1MEN1CYP1A2CYP2C9
SCHEMBL26347053 0.80 PPM1B (0.43) ALDH1A1MEN1CYP1A2CYP2C19KMT2A
SCHEMBL19115141 0.78 CYP2C19 (0.33) CYP2C19SLC6A4SLC6A3SLC6A2
SCHEMBL20313807 0.78 KMT2A (0.31) ALDH1A1KMT2ANPSR1
SCHEMBL13897031 0.78 SMN1; SMN2 (0.34) TSHR
SCHEMBL18461227 0.78 CYP2C19 (0.33) CYP2C19SLC6A4SLC6A3SLC6A2
SCHEMBL18120296 0.78 CYP2C19 (0.33) CYP2C19SLC6A4SLC6A3SLC6A2

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-20140080984-A1 HIGHLY ACTIVE METATHESIS CATALYSTS SELECTIVE FOR ROMP AND RCM REACTIONS ZANNA SCITECH CO., LTD. (CN) 2014-03-20 US disclosed
US-20110172381-A1 HIGHLY ACTIVE METATHESIS CATALYSTS SELECTIVE FOR ROMP AND RCM REACTIONS ZANNA SCITECH CO., LTD. (CN) 2011-07-14 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-20110172381-A1 HIGHLY ACTIVE METATHESIS CATALYSTS SELECTIVE FOR ROMP AND RCM REACTIONS RCSD1, RRP12, TIAM1 CYP19A1 1472/4885ALDH1A1 3240/4885MEN1 1844/4885

“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.