SCHEMBL2369355

SCHEMBL2369355

Fc1cc(Cc2ccccn2)cc(Nc2nc3ccc(Br)cc3s2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 1/20 0.45
CYP2D6 P10635 1/20 0.45
SLC2A1 P11166 1/20 0.41
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CSNK2A1 P68400 1/20 0.40
CSNK2A3 Q8NEV1 1/20 0.40
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
PKM P14618 1/20 0.39
AGTR1 P30556 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
SCHEMBL2370684 0.81 ITK (0.55) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2370678 0.81 ITK (0.55) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL141266 0.78 AURKB (0.51) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL31738383 0.75 CYP1A2 (0.54) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL31738384 0.75 CYP1A2 (0.54) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2369646 0.74 RAB9A (0.49) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2369866 0.74 AURKB (0.46) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL9375356 0.71 RAB9A (0.47) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2370728 0.71 L3MBTL1 (0.51) MAPTCYP1A2CYP2D6RAB9ASMN1; SMN2
SCHEMBL15673444 0.71 RAB9A (0.48) MAPTCYP1A2CYP3A4CYP2C9CYP2C19

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-2011110575-A1 DERIVATIVES OF 2-[2-(BENZO- OR PYRIDO-) THIAZOLYLAMINO]-6-AMINOPYRIDINE, USEFUL IN THE TREATMENT OF RESPIRATORIC, ALLERGIC OR INFLAMMATORY DISEASES GLAXO GROUP LIMITED (GB) 2011-09-15 WO disclosed