SCHEMBL27915910

SCHEMBL27915910

CC(C)(C)C(=O)ON1CCN(C(=O)c2cc(N)ccn2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
CFTR P13569 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
HRH3 Q9Y5N1 2/20 0.35
GAA P10253 1/20 0.35
RBP4 P02753 1/20 0.35
TRPC6 Q9Y210 4/20 0.35
NR1H2 P55055 1/20 0.34
DPP4 P27487 1/20 0.34
DPP9 Q86TI2 1/20 0.34
PIK3C3 Q8NEB9 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
OPRD1 P41143 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL3400739 0.82 POLB (0.53) CFTRPOLBNR1H2
SCHEMBL27874881 0.81 L3MBTL1 (0.66) L3MBTL1SMN1; SMN2GAARBP4
SCHEMBL3401608 0.79 HRH4 (0.50) L3MBTL1CFTRSMN1; SMN2POLBHRH3
SCHEMBL27853340 0.78 CA12 (0.53) LMNASMN1; SMN2GAA
SCHEMBL28050310 0.78 TRPC6 (0.38) HRH3TRPC6
SCHEMBL27934400 0.77 KDM5C (0.40) L3MBTL1LMNAPOLB
SCHEMBL27751339 0.77 CA12 (0.51) LMNASMN1; SMN2HSD17B10POLB
SCHEMBL27820419 0.77 POLB (0.36) L3MBTL1CFTRLMNASMN1; SMN2HSD17B10
SCHEMBL28289049 0.75 ALDH1A1 (0.50) L3MBTL1LMNASMN1; SMN2POLBGAA
SCHEMBL28050305 0.74 RAB9A (0.37) LMNASMN1; SMN2HSD17B10HRH3KCNH2

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
CN-101981036-B Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2013-09-04 CN disclosed