SCHEMBL28112677

SCHEMBL28112677

Cc1ccc(N2CCN(OC(=O)C(C)(C)C)CC2)c(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HTT P42858 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 4/20 0.43
HPGD P15428 2/20 0.43
POLB P06746 1/20 0.38
TSHR P16473 3/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
IGF1R P08069 1/20 0.34
RBP4 P02753 1/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL27621448 0.86 MAPT (0.38) LMNASMN1; SMN2ALDH1A1HTTMAPT
SCHEMBL28255189 0.83 F2 (0.34) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL27697694 0.82 MEN1 (0.40) LMNASMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL28256705 0.81 USP28 (0.35) LMNASMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL27656469 0.78 HTR6 (0.52) LMNASMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL28840342 0.77 POLB (0.42) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL27944975 0.76 MAPT (0.52) LMNASMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL28001305 0.76 TRPV1 (0.40) LMNAHPGDTP53
SCHEMBL28293019 0.74 LMNA (0.36) LMNASMN1; SMN2ALDH1A1HTTMAPT
SCHEMBL28794456 0.74 MEN1 (0.39) LMNASMN1; SMN2ALDH1A1HTTMEN1

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
CN-106279071-A Phenylpiperazine derivatives and using method thereof and purposes 广东东阳光药业有限公司 2017-01-04 CN disclosed