SCHEMBL7464904

SCHEMBL7464904

O=C1c2ccccc2-c2nc3ccc(O)cc3c(Cl)c21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRB O95718 4/20 0.45
ESRRA P11474 4/20 0.45
RAB9A P51151 5/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PKM P14618 2/20 0.44
HTT P42858 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
MAPT P10636 4/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 1/20 0.41
AHR P35869 1/20 0.41
ADORA2A P29274 3/20 0.41
ADORA1 P30542 3/20 0.41
HPGDS O60760 1/20 0.40
MAOB P27338 1/20 0.40
TOP1 P11387 1/20 0.39
BCL2 P10415 1/20 0.39
MCL1 Q07820 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
SCHEMBL7464639 0.80 TP53 (0.60) RAB9AMEN1KMT2APKMHTT
SCHEMBL8806165 0.74 TOP1 (0.40) RAB9AMEN1KMT2APKMHTT
SCHEMBL16479373 0.74 ESR1 (0.43) ESRRBESRRAMEN1KMT2AALDH1A1
SCHEMBL8573824 0.73 TOP1 (0.48) ADORA2AADORA1TOP1
SCHEMBL7458826 0.72 TP53 (0.60) RAB9AMEN1KMT2APKMHTT
SCHEMBL16645288 0.72 RORC (0.56) ESRRBESRRAESR1ESR2
SCHEMBL7818757 0.70 TOP1 (0.56) RAB9AMEN1KMT2AHTTMAPT
SCHEMBL7818521 0.69 GUSB (0.45) MAOBTOP1BCL2MCL1ESR1
SCHEMBL7464693 0.69 ACHE (0.51) MEN1KMT2AADORA2AADORA1TP53
SCHEMBL7464351 0.69 ACHE (0.51) MEN1KMT2AADORA2AADORA1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0785191-B1 FUSED INDAN DERIVATIVES AND SALTS THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2002-10-23 EP disclosed
US-5763453-A ANTITUMOR AGENTS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed
EP-0785191-A1 FUSED INDAN DERIVATIVES AND SALTS THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-07-23 EP disclosed