SCHEMBL4511488

SCHEMBL4511488

COC(=O)c1ccc(CCC(C=Cc2ccccc2OCCCCCc2ccccc2)Cc2ccc(C#N)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 2/20 0.41
HPGD P15428 2/20 0.41
CTSG P08311 2/20 0.40
CMA1 P23946 2/20 0.40
PRSS1 P07477 1/20 0.40
CTRB1 P17538 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 1/20 0.38
RAB9A P51151 3/20 0.38
LMNA P02545 3/20 0.38
NPC1 O15118 2/20 0.38
HTT P42858 2/20 0.38
PDE4A P27815 2/20 0.38
PDE4B Q07343 2/20 0.38

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
SCHEMBL3485095 1.00 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL4511480 1.00 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL3484621 1.00 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL4492263 1.00 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL3484620 1.00 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL3485099 1.00 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL3484461 0.99 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL3484457 0.99 KMT2A (0.42) KMT2AMEN1POLBPKMBLM
SCHEMBL3484092 0.97 KMT2A (0.43) KMT2AMEN1POLBPKMBLM
SCHEMBL3484088 0.97 KMT2A (0.43) KMT2AMEN1POLBPKMBLM

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 KMT2A 3974/4885MEN1 3290/4885POLB 3385/4885

“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.