SCHEMBL2282012

SCHEMBL2282012

COC(=O)c1cccc2c1-c1c(C3CCCCC3)c3ccccc3n1CC(/C=C/C(=O)OC(C)(C)C)CO2

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.36
MMP12 P39900 1/20 0.36
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HTR4 Q13639 1/20 0.30

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
SCHEMBL2282016 1.00 PRKCA (0.36) PRKCAMMP12ALDH1A1TSHRHSD17B10
SCHEMBL2276974 0.88 PRKCA (0.40) PRKCAMMP12ALDH1A1TSHRHSD17B10
SCHEMBL2275975 0.83 PRKCA (0.52) PRKCAMMP12
SCHEMBL2275971 0.83 PRKCA (0.52) PRKCAMMP12
SCHEMBL2279340 0.76 PRKCA (0.42) PRKCAMMP12L3MBTL1
SCHEMBL2278875 0.72 PRKCA (0.43) PRKCAMMP12HTR4
SCHEMBL4211523 0.71 PRKCA (0.45) PRKCAMMP12KDM4EHTR4
SCHEMBL4218773 0.70 PRKCA (0.44) PRKCAMMP12L3MBTL1
SCHEMBL2276849 0.68 PRKCA (0.58) PRKCAMMP12ALDH1A1NPC1NPSR1
SCHEMBL2280154 0.68 PRKCA (0.60) PRKCAMMP12ALDH1A1

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-7989438-B2 Therapeutic compounds ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-08-02 US disclosed
US-20090048239-A1 Therapeutic compounds MSD ITALIA S.R.L. (IT) 2009-02-19 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-20090048239-A1 Therapeutic compounds RRP1B, RCE1, CTSZ PRKCA 4250/4885MMP12 2067/4885ALDH1A1 1358/4885

“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.