SCHEMBL9080414

SCHEMBL9080414

[CH2]C(=O)N(N)c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
POLB P06746 3/20 0.43
KMT2A Q03164 3/20 0.42
HTT P42858 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.40
LMNA P02545 3/20 0.39
P4HTM Q9NXG6 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NAPRT Q6XQN6 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 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
SCHEMBL8668737 0.82 TSHR (0.46) TSHRPOLBKMT2AHTTNPC1
SCHEMBL19668416 0.82 TSHR (0.54) TSHRPOLBKMT2AHTTNPC1
SCHEMBL21588945 0.81 ALDH1A1 (0.47) TSHRPOLBKMT2AHTTNPC1
SCHEMBL28996726 0.80 TSHR (0.42) TSHRPOLBKMT2AHTTNPC1
SCHEMBL10992413 0.78 TSHR (0.43) TSHRPOLBKMT2AHTTNPC1
SCHEMBL424554 0.77 CYP2D6 (0.46) TSHRPOLBKMT2AHTTNPC1
SCHEMBL3366935 0.75 TSHR (0.51) TSHRPOLBKMT2AHTTNPC1
SCHEMBL28966865 0.74 KDM4E (0.39) TSHRPOLBKMT2AHTTNPC1
SCHEMBL10591727 0.74 LMNA (0.40) TSHRPOLBKMT2AHTTNPC1
SCHEMBL660286 0.74 MAPT (0.54) TSHRKMT2ANPC1RAB9AHSD17B10

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