SCHEMBL7960744

SCHEMBL7960744

COc1ccc(CC(=O)NC2(C(=O)O)CCC(OC)CC2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
APOBEC3A P31941 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
KDM1A O60341 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
SIGMAR1 Q99720 2/20 0.36
P2RX7 Q99572 1/20 0.36
CXCR5 P32302 2/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
WNT3A P56704 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL7960078 0.91 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7961954 0.90 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL6483794 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1SIGMAR1P2RX7
SCHEMBL7960093 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7960893 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL8653791 0.88 SHMT1 (0.43) HPGDSIGMAR1P2RX7
SCHEMBL7961525 0.88 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7949839 0.87 MEN1 (0.41) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7960420 0.86 MEN1 (0.46) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7961937 0.86 MEN1 (0.46) 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