SCHEMBL12184249

SCHEMBL12184249

CC(=O)N1CCC(Oc2cccc(C(F)(F)F)c2)C1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.56
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
TP53 P04637 1/20 0.52
ACACB O00763 2/20 0.51
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
ABHD6 Q9BV23 2/20 0.49
MGLL Q99685 1/20 0.49
SOS1 Q07889 1/20 0.49
FFAR1 O14842 1/20 0.48
LIPG Q9Y5X9 2/20 0.47
LIPC P11150 1/20 0.47
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
CHRM3 P20309 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
SCHEMBL16217379 0.89 CYP11B2 (0.47) EPHX2MEN1KMT2ACYP11B1CYP11B2
SCHEMBL10607268 0.88 EPHX2 (0.59) EPHX2MEN1KMT2ATP53ACACB
SCHEMBL9900709 0.86 USP30 (0.56) EPHX2MEN1KMT2ATP53ACACB
SCHEMBL21958728 0.86 TEAD1 (0.59) EPHX2MEN1KMT2ATP53SLC6A2
SCHEMBL21958727 0.86 TEAD1 (0.59) EPHX2MEN1KMT2ATP53SLC6A2
SCHEMBL2636858 0.86 EPHX2 (0.54) EPHX2MEN1KMT2ATP53ACACB
SCHEMBL2636860 0.85 EPHX2 (0.53) EPHX2MEN1KMT2ATP53ACACB
SCHEMBL9903075 0.84 EPHX2 (0.65) EPHX2MEN1KMT2ATP53SLC6A2
SCHEMBL10606837 0.83 EPHX2 (0.53) EPHX2MEN1KMT2ATP53ACACB
SCHEMBL10606827 0.82 EPHX2 (0.64) EPHX2MEN1KMT2ATP53ACACB

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-2011142359-A1 SPIRO COMPOUND AND DRUG FOR ACTIVATING ADIPONECTIN RECEPTOR 日産化学工業株式会社 (JP) 2011-11-17 WO disclosed