SCHEMBL9079754

SCHEMBL9079754

O=C(Nc1cccn2c(-c3cccnc3)c(C(F)(F)F)nc12)c1c(Cl)cccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.47
SCN5A Q14524 6/20 0.46
SCN9A Q15858 6/20 0.46
IDO1 P14902 4/20 0.44
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TYK2 P29597 2/20 0.42
MAPT P10636 2/20 0.39
MCL1 Q07820 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CRHBP P24387 1/20 0.39
HTT P42858 1/20 0.39
CRHR2 Q13324 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGA4 P13612 1/20 0.39
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
LCK P06239 1/20 0.38

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
SCHEMBL9080176 0.89 MEN1 (0.42) SCN5ASCN9ANPC1RAB9ATYK2
SCHEMBL9081129 0.85 SMN1; SMN2 (0.39) SCN5ASCN9ANPC1RAB9ATYK2
SCHEMBL9080721 0.83 KMT2A (0.46) TYK2MEN1KMT2ACRHBPHTT
SCHEMBL9082025 0.83 MEN1 (0.39) NPC1RAB9ATYK2MEN1KMT2A
SCHEMBL9079922 0.82 EPHB3 (0.39) SCN5ASCN9ATYK2MEN1KMT2A
Hydrochloric Acid SCHEMBL9227723 0.81 NPC1 (0.43) IRAK4SCN5ASCN9ANPC1RAB9A
SCHEMBL9080374 0.80 RECQL (0.48) NPC1RAB9ATYK2MAPTKMT2A
SCHEMBL9227383 0.80 NR1H2 (0.41) TYK2MAPTHTTSMN1; SMN2ALDH1A1
SCHEMBL9080651 0.79 KMT2A (0.44) TYK2MAPTMEN1KMT2ACRHBP
Hydrochloric Acid SCHEMBL9080890 0.79 SCN5A (0.38) IRAK4SCN5ASCN9ATYK2MAPT

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-1996034866-A1 IMIDAZO 1,2-A PYRIDINE AND IMIDAZO 1,2-A PYRIDEZINE DERIVATIVES AND THEIR USE AS BONE RESORPTION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-07 WO disclosed