SCHEMBL6963629

SCHEMBL6963629

Cc1nn(C(=O)OC(C)(C)C)c(C)c1N=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.38
ELANE P08246 1/20 0.32
SLC2A1 P11166 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
USP2 O75604 1/20 0.30
MAP2K4 P45985 1/20 0.30

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
SCHEMBL10236319 0.77 FAAH (0.40) FAAHELANESMN1; SMN2USP2
SCHEMBL3086177 0.77 FAAH (0.40) FAAHELANESMN1; SMN2USP2
SCHEMBL3231153 0.77 ALDH1A1 (0.47) FAAHELANELMNATP53KMT2A
SCHEMBL14060432 0.74 FAAH (0.38) FAAHELANESMN1; SMN2USP2
SCHEMBL28915641 0.74 FAAH (0.41) FAAHELANESMN1; SMN2PTGDR2USP2
SCHEMBL10279632 0.74 FAAH (0.41) FAAHELANESMN1; SMN2PTGDR2USP2
SCHEMBL6956991 0.73 CYP1A2 (0.43) FAAHELANEPTGDR2LMNA
SCHEMBL30676944 0.72 ALDH1A1 (0.40) FAAHELANESMN1; SMN2LMNATP53
SCHEMBL30676992 0.72 ALDH1A1 (0.40) FAAHELANELMNATP53KMT2A
SCHEMBL2955684 0.71 FAAH (0.41) FAAHELANESMN1; SMN2USP2

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed