SCHEMBL9704624

SCHEMBL9704624

Clc1cc2nc3c(nc2cc1Cl)N(c1ccccc1)CN3c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
NPC1 O15118 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
HRH4 Q9H3N8 4/20 0.46
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 6/20 0.44
MAPT P10636 5/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
BLM P54132 1/20 0.44
CASP9 P55211 1/20 0.44
CASP6 P55212 1/20 0.44
CASP8 Q14790 1/20 0.44
GAA P10253 3/20 0.43
HPGD P15428 3/20 0.43
MAPK1 P28482 1/20 0.39
UBE2N P61088 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL4640583 0.85 HRH4 (0.43) MEN1KMT2ANPC1RXFP1HRH4
SCHEMBL9463960 0.83 KDM4E (0.49) MEN1KMT2ANPC1RXFP1HRH4
SCHEMBL9705990 0.76 KDM4E (0.46) MEN1KMT2ANPC1RXFP1HRH4
SCHEMBL24850989 0.69 SIGMAR1 (0.41) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL8686412 0.67 NQO2 (0.62) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL31070211 0.65 KDM4E (0.61) MEN1KMT2ANPC1RXFP1KDM4E
SCHEMBL12787331 0.65 SIGMAR1 (0.41) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL30988605 0.64 LOX (0.36) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL12124147 0.63 MAPK13 (0.53) HRH4GAAMAPK1GLP1R
SCHEMBL30862468 0.62 LOX (0.35) MEN1KMT2ANPC1KDM4EALDH1A1

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-5142545-A LASER DYE LAMBDA PHYSIK GESELLSCHAFT ZUR HERSTELLUNG VON LASERN MBH (DE) 1992-08-25 US claimed
US-4713316-A INFRARED SENSITIZING DYES, MOBILE DYE PRECURSORS, ALKALI, SILVER HALIDE EMULSION FUJI PHOTO FILM CO., LTD. (JP) 1987-12-15 US disclosed