SCHEMBL789128

SCHEMBL789128

CC(C)(C)N1CCC(NC(=O)C(Br)CCBr)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.35
ALDH1A1 P00352 1/20 0.33
SIGMAR1 Q99720 3/20 0.33
EPHX1 P07099 3/20 0.32
SSTR1 P30872 2/20 0.32
SSTR4 P31391 2/20 0.32
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 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
SCHEMBL27928621 0.84 ALDH1A1 (0.33) EPHX2ALDH1A1SIGMAR1EPHX1SSTR1
SCHEMBL15114600 0.84 FPR2 (0.41) EPHX2ALDH1A1SIGMAR1EPHX1SSTR1
SCHEMBL8806885 0.81 KMT2A (0.43) EPHX2ALDH1A1SIGMAR1EPHX1KDM4E
SCHEMBL789907 0.80 EPHX1 (0.55) EPHX2ALDH1A1EPHX1KDM4EKMT2A
SCHEMBL788997 0.79 EPHX2 (0.36) EPHX2EPHX1KDM4E
SCHEMBL8559580 0.77 HPGD (0.52) ALDH1A1KMT2A
SCHEMBL16072939 0.77 EPHX2 (0.41) EPHX2ALDH1A1SIGMAR1EPHX1KDM4E
SCHEMBL27343743 0.74 EPHX1 (0.48) EPHX2SIGMAR1EPHX1HDAC4HDAC1
SCHEMBL25537481 0.74 EPHX2 (0.39) EPHX2ALDH1A1SIGMAR1EPHX1KDM4E
SCHEMBL2597299 0.73 EPHX1 (0.53) EPHX2ALDH1A1EPHX1HDAC4HDAC1

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-2616074-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-07-24 EP disclosed
WO-2012037393-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2012-03-22 WO disclosed