SCHEMBL4495322

SCHEMBL4495322

CC(C)(C)c1ccc(COc2ccccc2C=CC(CCCCC(=O)O)Cc2ccc(C#N)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.38
NR4A2 P43354 2/20 0.37
NR4A1 P22736 1/20 0.37
NR4A3 Q92570 1/20 0.37
PTGER1 P34995 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
XDH P47989 2/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
PKM P14618 1/20 0.36
BLM P54132 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EPHX2 P34913 1/20 0.36
FFAR1 O14842 2/20 0.35
FABP3 P05413 1/20 0.35
RXRA P19793 1/20 0.35

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
SCHEMBL4495315 1.00 MAOB (0.38) MAOBNR4A2NR4A1NR4A3PTGER1
SCHEMBL2295005 0.93 NPSR1 (0.38) NR4A2PTGER1PTGER4PTGER3PTGER2
SCHEMBL2295011 0.93 NPSR1 (0.38) NR4A2PTGER1PTGER4PTGER3PTGER2
SCHEMBL2293422 0.90 CTSG (0.37) NR4A2NR4A1NR4A3XDHNPSR1
SCHEMBL2293418 0.90 CTSG (0.37) NR4A2NR4A1NR4A3XDHNPSR1
SCHEMBL13463257 0.87 KMT2A (0.44) PTGER1PTGER4PTGER3PTGER2KMT2A
SCHEMBL2292394 0.86 RXRA (0.45) NR4A2NR4A1NR4A3PTGER1PTGER4
SCHEMBL2293675 0.86 RXRA (0.45) NR4A2NR4A1NR4A3PTGER1PTGER4
SCHEMBL2297691 0.86 RXRA (0.45) NR4A2NR4A1NR4A3PTGER1PTGER4
SCHEMBL2293682 0.86 RXRA (0.45) NR4A2NR4A1NR4A3PTGER1PTGER4

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 MAOB 1078/4885NR4A2 1308/4885NR4A1 2135/4885

“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.