SCHEMBL14620979

SCHEMBL14620979

Cc1c2cccnc2nn1CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46
▸ ALOX15 P16050 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ PTGDR2 Q9Y5Y4 6/20 0.41
▸ PANK1 Q8TE04 1/20 0.41
▸ PANK3 Q9H999 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL1637819 0.82 ALOX15 (0.42) ALDH1A1ALOX15GAARAB9AHSD17B10
SCHEMBL1638692 0.82 ALOX15 (0.42) ALOX15GAARAB9AHSD17B10RXFP1
SCHEMBL4066238 0.76 ALOX15 (0.51) ALDH1A1ALOX15GAARAB9AHSD17B10
SCHEMBL12726405 0.72 MAOB (0.39) PANK1PANK3TSHRHTTSMN1; SMN2
SCHEMBL1639832 0.71 ALOX15 (0.43) ALOX15RAB9AHSD17B10PTGDR2TSHR
SCHEMBL28709455 0.71 TRPA1 (0.56) ALDH1A1GAARAB9ALMNASMN1; SMN2
SCHEMBL12479695 0.71 CFD (0.50) —
SCHEMBL1638885 0.70 MEN1 (0.47) ALDH1A1GAATSHRHTT
SCHEMBL1639229 0.70 GAA (0.47) ALDH1A1GAAHSD17B10TSHRHTT
SCHEMBL21297851 0.70 L3MBTL1 (0.42) HTT

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-2007002293-A2 AZAINDAZOLE COMPOUNDS AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-01-04 — — WO disclosed
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