SCHEMBL7345446

SCHEMBL7345446

CCOC(=O)C=C(C)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
CASP3 P42574 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
CYP1A2 P05177 2/20 0.47
LMNA P02545 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
PRSS1 P07477 1/20 0.41
MAOB P27338 2/20 0.41

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
SCHEMBL26364967 1.00 MAPT (0.48) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL7345443 1.00 MAPT (0.48) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL5520042 0.95 MAPT (0.44) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL5520040 0.95 MAPT (0.44) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL14615017 0.95 MAPT (0.44) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL10516777 0.89 PTPN1 (0.41) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL12883157 0.86 MAPT (0.45) MAPTKMT2AMEN1CYP1A2LMNA
SCHEMBL14499482 0.86 MAPT (0.45) MAPTKMT2AMEN1CYP1A2LMNA
SCHEMBL26845457 0.86 MAPT (0.45) MAPTKMT2AMEN1CYP1A2LMNA
SCHEMBL10514962 0.85 KMT2A (0.40) MAPTKMT2AMEN1CASP3TRPV1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115427028-A Selective Androgen Receptor Covalent Antagonists (SARCA) and methods of use thereof 田纳西大学研究基金会 2022-12-02 CN disclosed
EP-0329691-B1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1991-11-21 EP disclosed
US-4737511-A Cardiotonic imidazolylphenylpyrrol-2-ones SCHERING A.G. (DE) 1988-04-12 US disclosed