Sugi Predict

Sugi Predict / Compounds / SCHEMBL8524960

SCHEMBL8524960

SCHEMBL8524960

Cn1c(C(N)=O)cc(=O)n(-c2ccc(OCc3ccc(Cl)cc3)cc2F)c1=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 8/20 0.50
▸ MAOA P21397 4/20 0.50
▸ MCHR1 Q99705 4/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ PARP10 Q53GL7 2/20 0.40
▸ AMPD2 Q01433 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.38
▸ SRD5A1 P18405 1/20 0.38
▸ NR4A2 P43354 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
SCHEMBL8524033 0.91 MAOB (0.47) MAOBMAOAMCHR1KCNH2SRD5A1
SCHEMBL8525104 0.91 MAOB (0.51) MAOBMAOAMCHR1KCNH2HRH3
SCHEMBL9114664 0.84 MAOB (0.47) MAOBMAOAMCHR1KCNH2SRD5A1
SCHEMBL8524954 0.83 MAOB (0.49) MAOBMAOAMCHR1KCNH2HRH3
SCHEMBL8525105 0.83 MAOB (0.49) MAOBMAOAMCHR1KCNH2HRH3
SCHEMBL8523914 0.81 MAOB (0.46) MAOBMAOAMCHR1KCNH2SRD5A1
SCHEMBL7610528 0.75 MAOB (0.43) MAOBMAOAMCHR1KCNH2SRD5A1
SCHEMBL7236458 0.74 MAOB (0.38) MAOBMAOAMCHR1KCNH2HRH3
SCHEMBL8525409 0.74 MAOB (0.49) MAOBMAOAHRH3NR4A2
SCHEMBL7677446 0.73 HDAC1 (0.40) MAOBMAOAMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999001440-A1 SUBSTITUTED ARYLURACIL HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-01-14 — — WO disclosed