SCHEMBL7960982

SCHEMBL7960982

COC(=O)C1(NC(=O)Cc2ccc(OC)cc2C)CCC(C(C)(C)C)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 4/20 0.41
HPGD P15428 1/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
WNT3A P56704 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EPHX2 P34913 2/20 0.36
P2RX7 Q99572 2/20 0.35
ANO1 Q5XXA6 1/20 0.34
RXFP1 Q9HBX9 1/20 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
SCHEMBL7960093 0.92 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL8907373 0.89 P2RX7 (0.38) MEN1KMT2AALDH1A1HPGDP2RX7
SCHEMBL7950115 0.89 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL6482176 0.88 KMT2A (0.41) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL7960078 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL8795400 0.88 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL8656926 0.87 ANO1 (0.41) KMT2AALDH1A1HPGDP2RX7ANO1
SCHEMBL7958037 0.87 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7957823 0.87 ALDH1A1 (0.35) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL7960737 0.87 KMT2A (0.44) MEN1KMT2AALDH1A1HPGDAPOBEC3A

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-6172255-B1 INSECTICIDES; MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-09 US disclosed
US-5830826-A Alkoxy-alkyl-substituted 1H-3-aryl-pyrrolidine-2, 4-diones used as herbicicides and pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed