SCHEMBL4515115

SCHEMBL4515115

N#Cc1ccc(CC(C=Cc2ccccc2O)CCc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.40
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
PRSS1 P07477 1/20 0.38
CTSG P08311 1/20 0.38
CTRB1 P17538 1/20 0.38
CMA1 P23946 1/20 0.38
AR P10275 1/20 0.37
HAT1 O14929 2/20 0.35
EP300 Q09472 2/20 0.35
FFAR1 O14842 2/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
KMT2A Q03164 1/20 0.34
PTGER4 P35408 2/20 0.34
PTGER2 P43116 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
SCHEMBL4515111 1.00 TAS2R14 (0.40) TAS2R14MMP12MMP13PRSS1CTSG
SCHEMBL2292822 0.88 PRSS1 (0.40) MMP12MMP13PRSS1CTSGCTRB1
SCHEMBL2292828 0.88 PRSS1 (0.40) MMP12MMP13PRSS1CTSGCTRB1
SCHEMBL2295663 0.88 PRSS1 (0.40) MMP12MMP13PRSS1CTSGCTRB1
SCHEMBL2295655 0.88 PRSS1 (0.40) MMP12MMP13PRSS1CTSGCTRB1
SCHEMBL3484444 0.86 RXRA (0.41) TAS2R14PRSS1CTSGCTRB1CMA1
SCHEMBL3484440 0.86 RXRA (0.41) TAS2R14PRSS1CTSGCTRB1CMA1
SCHEMBL15492185 0.84 CTSG (0.36) MMP12MMP13PRSS1CTSGCTRB1
SCHEMBL4508822 0.81 MMP12 (0.41) MMP12MMP13PRSS1CTSGCTRB1
SCHEMBL4508829 0.81 MMP12 (0.41) MMP12MMP13PRSS1CTSGCTRB1

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-8183271-B2 Tetrazole derivatives and their use for the treatment of cardiovascular diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-05-22 US disclosed
US-20090215843-A1 Tetrazole Derivatives and Their Use for the Treatment of Cardiovascular Diseases BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-08-27 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-20090215843-A1 Tetrazole Derivatives and Their Use for the Treatment of Cardiovascular Diseases TNNI3, TNNT2, FABP3 TAS2R14 1981/4885MMP12 1896/4885MMP13 1615/4885

“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.