SCHEMBL3956362

SCHEMBL3956362

CC(C)(C)c1ccc(NC(=O)C=C2CCN3CCCC2C3)cc1.[CH2]

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.41
EPHX1 P07099 1/20 0.41
CNR2 P34972 7/20 0.41
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
CNR1 P21554 3/20 0.39
TRPV1 Q8NER1 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
CXCR3 P49682 1/20 0.37
CCR3 P51677 1/20 0.37
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3966365 0.89 TGM2 (0.43) EPHX2TRPV1
SCHEMBL3958588 0.88 RAB9A (0.41) EPHX1RAB9AKMT2AALDH1A1HTT
SCHEMBL3956114 0.85 KMT2A (0.42) EPHX1RAB9AMEN1KMT2AALDH1A1
SCHEMBL3959574 0.80 CYP1A2 (0.46) EPHX2EPHX1RAB9ALMNAMEN1
SCHEMBL3959493 0.77 NAMPT (0.44) EPHX2RAB9ALMNAALDH1A1HTT
SCHEMBL3966975 0.74 HTT (0.39) RAB9ALMNAMEN1KMT2AHTT
SCHEMBL3965951 0.72 NPY5R (0.35) RAB9ALMNACNR1GAANPC1
SCHEMBL2092137 0.71 TRPV1 (0.40) EPHX2EPHX1CNR2RAB9ALMNA
SCHEMBL3968445 0.71 HRH3 (0.47) EPHX1RAB9ALMNAMEN1KMT2A
SCHEMBL2090181 0.70 TRPV1 (0.39) EPHX2EPHX1CNR2RAB9ALMNA

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-2069346-A1 ACETAMIDE AND CARBOXAMIDE DERIVATIVES OF AZAADAMANTANE AND METHODS OF USE THEREOF Abbott Laboratories (US) 2009-06-17 EP disclosed
WO-2008118743-A1 ACETAMIDE AND CARBOXAMIDE DERIVATIVES OF AZAADAMANTANE AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2008-10-02 WO disclosed