SCHEMBL7960893

SCHEMBL7960893

CCC1CCC(NC(=O)Cc2ccc(OC)cc2C)(C(=O)O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
KDM1A O60341 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
FFAR4 Q5NUL3 1/20 0.37
HTT P42858 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL7958037 0.92 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7960229 0.90 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL6483626 0.89 FFAR4 (0.43) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL7961954 0.89 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7960744 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7960093 0.87 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL8906515 0.87 P2RX7 (0.41) MEN1KMT2AHPGDNPC1RAB9A
SCHEMBL7961525 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7949839 0.86 MEN1 (0.41) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL7958016 0.86 KMT2A (0.37) 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