SCHEMBL3673656

SCHEMBL3673656

CC1CCN(NC(=O)OCc2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 2/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSK P43235 1/20 0.48
HTT P42858 1/20 0.48
LIPE Q05469 1/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTR2C P28335 1/20 0.46
CPB1 P15086 1/20 0.45
ACHE P22303 1/20 0.45
PREP P48147 1/20 0.45

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
SCHEMBL9523945 0.87 ALDH1A1 (0.50) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL7138245 0.85 ALDH1A1 (0.48) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL8037871 0.84 ALDH1A1 (0.47) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL3864756 0.82 HTT (0.53) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL2553604 0.82 HTT (0.53) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL9381194 0.82 CTSL (0.53) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL27518811 0.82 TSHR (0.46) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL28743107 0.80 CTSL (0.48) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL5647759 0.80 LIPE (0.49) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL5115089 0.80 GAA (0.52) ALDH1A1GAACTSLCTSBCTSK

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
EP-2139888-A2 IMIDAZOÝ1,2-A¨PYRIDINE COMPOUNDS AS RECEPTOR TYROSINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2010-01-06 EP disclosed
WO-2008121687-A2 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS RECEPTOR TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-10-09 WO disclosed