SCHEMBL11546292

SCHEMBL11546292

CC(=O)c1cc(Cl)c(NC(=O)Nc2ccccc2)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.64
MEN1 O00255 9/20 0.64
RAB9A P51151 8/20 0.63
NPC1 O15118 8/20 0.63
MAPT P10636 8/20 0.63
SMN1; SMN2 Q16637 6/20 0.63
TAAR1 Q96RJ0 2/20 0.63
NPSR1 Q6W5P4 2/20 0.54
TP53 P04637 2/20 0.53
EPHX1 P07099 1/20 0.53
TSHR P16473 1/20 0.53
EPHX2 P34913 1/20 0.53
CDK9 P50750 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53
LMNA P02545 4/20 0.53
HTT P42858 3/20 0.53
NLRP1 Q9C000 1/20 0.53
ALDH1A1 P00352 1/20 0.51
KDM4E B2RXH2 1/20 0.48
POLB P06746 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
SCHEMBL11547089 0.81 KMT2A (0.51) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL4918597 0.78 KMT2A (1.00) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL11544341 0.78 ALDH1A1 (0.43) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL1719786 0.78 RAB9A (1.00) KMT2AMEN1RAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL8615399 0.76 MEN1 (0.47) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL11543525 0.74 JAK2 (0.39) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL28810823 0.73 KMT2A (0.76) KMT2AMEN1RAB9ANPC1MAPT
Diphenylurea SCHEMBL133103 0.73 SMN1; SMN2 (1.00) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL11545759 0.73 SMN1; SMN2 (0.41) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL11007336 0.73 KMT2A (0.70) KMT2AMEN1RAB9ANPC1MAPT

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-4145363-A ANTIASTHMATICS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1979-03-20 US disclosed
US-4063025-A PROPHYLAXIS, ANTIASTHMATIC YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) 1977-12-13 US disclosed