SCHEMBL7720189

SCHEMBL7720189

COc1ccc(-c2cc(C(=O)NCc3ccccc3)c(=O)n(C)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 1/20 0.58
HDAC1 Q13547 2/20 0.56
TP53 P04637 4/20 0.54
MAPT P10636 3/20 0.54
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
ALDH1A1 P00352 1/20 0.51
POLB P06746 1/20 0.51
PKM P14618 1/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PHGDH O43175 1/20 0.51
BRD4 O60885 1/20 0.51
GSK3B P49841 1/20 0.50
KDM1A O60341 1/20 0.50
UBE2I P63279 1/20 0.49
CACNA1B Q00975 1/20 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
SCHEMBL7730191 0.86 ADORA2A (0.59) TP53MAPTNPC1RAB9AHTT
SCHEMBL7723469 0.84 JAK2 (0.52) MAPTNPC1RAB9AHTTSMN1; SMN2
SCHEMBL7724827 0.83 TACR3 (0.52) TACR3HDAC1TP53MAPTNPC1
SCHEMBL7724857 0.82 L3MBTL1 (0.50) TACR3HDAC1TP53MAPTNPC1
SCHEMBL7723102 0.79 PLA2G2A (0.54) MAPTNPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL7720270 0.79 MAPT (0.59) HDAC1MAPTNPC1RAB9AHTT
SCHEMBL7720232 0.75 MAPT (0.54) MAPTNPC1RAB9AHTTSMN1; SMN2
SCHEMBL7720271 0.74 MAPT (0.64) HDAC1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL7723670 0.73 MAPT (0.63) HDAC1MAPTSMN1; SMN2ALDH1A1POLB
SCHEMBL23495195 0.73 TP53 (0.72) TP53MAPTHTTSMN1; SMN2ALDH1A1

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-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed