SCHEMBL19632886

SCHEMBL19632886

CCN(C(=O)Nc1ccc(OC)cc1)c1ccc(Br)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
FPR2 P25090 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 5/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TP53 P04637 1/20 0.50
ESR2 Q92731 1/20 0.50
NOX1 Q9Y5S8 1/20 0.50
ALDH1A1 P00352 5/20 0.49

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
SCHEMBL19708072 0.90 MEN1 (0.66) KMT2AMEN1TDP1LMNAMAPT
SCHEMBL8345899 0.75 MCHR1 (0.56) KMT2AMEN1LMNAMAPTNPC1
SCHEMBL19707272 0.75 KMT2A (0.65) KMT2AMEN1TDP1LMNAMAPT
SCHEMBL19427499 0.75 NPC1 (0.63) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL5454456 0.75 HTT (0.51) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL19825005 0.75 NPC1 (0.63) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL18614121 0.73 KMT2A (0.55) KMT2AMEN1FPR2LMNAMAPT
SCHEMBL5702218 0.73 RNF4 (0.51) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL15984777 0.73 SMN1; SMN2 (0.62) KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL7539909 0.73 KMT2A (0.47) KMT2AMEN1MAOAMAOBTDP1

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-2017201187-A1 LIM KINASE INHIBITORS VIRONGY, LLC (US) 2017-11-23 WO disclosed