SCHEMBL9403360

SCHEMBL9403360

CC(=O)Nc1cccc2cc(OCc3ccccc3)ccc12

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.58
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALOX5 P09917 1/20 0.52
MAOB P27338 5/20 0.51
MRGPRX4 Q96LA9 1/20 0.51
CASP6 P55212 1/20 0.51
LMNA P02545 1/20 0.50
P2RY14 Q15391 1/20 0.49
MAOA P21397 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL11690882 0.82 MAOB (0.51) MEN1KMT2AALOX5MAOBMRGPRX4
SCHEMBL8662697 0.80 CASP6 (0.59) MEN1KMT2ACASP6LMNANPC1
SCHEMBL22762667 0.79 KDM4E (0.60) BRD4MEN1KMT2AMAOBLMNA
SCHEMBL11829865 0.79 BRD4 (0.59) BRD4MEN1KMT2AMAOBLMNA
SCHEMBL11650244 0.78 BRD4 (0.58) BRD4MEN1KMT2AMAOBLMNA
SCHEMBL9724661 0.78 MAOB (0.60) BRD4MEN1KMT2AMAOBLMNA
SCHEMBL2993876 0.78 BRD4 (0.69) BRD4MEN1KMT2A
SCHEMBL28451935 0.78 BRD4 (0.58) BRD4MEN1KMT2AMAOBMRGPRX4
SCHEMBL4895612 0.77 BRD4 (0.57) BRD4MEN1KMT2AMAOBLMNA
SCHEMBL3997171 0.77 BRD4 (0.60) BRD4MEN1KMT2AMAOBLMNA

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
US-5338740-A Angiotensin II receptor antagonists PFIZER INC. (US) 1994-08-16 US disclosed