SCHEMBL7208600

SCHEMBL7208600

CCCCCN(C)CCCCCCCOC1CCC(N(C)C(=S)Nc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
HTT P42858 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
LSS P48449 5/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
KCNH2 Q12809 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
EPHX2 P34913 1/20 0.35
LIPC P11150 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
ALOX12 P18054 1/20 0.34
RECQL P46063 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
SCHEMBL7208602 1.00 LMNA (0.41) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL7208799 0.97 LMNA (0.42) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL7208794 0.97 LMNA (0.42) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL7203964 0.89 USP30 (0.45) LSSKCNH2GPR119EPHX2
SCHEMBL7203967 0.89 USP30 (0.45) LSSKCNH2GPR119EPHX2
SCHEMBL7211442 0.89 LMNA (0.39) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL7211436 0.89 LMNA (0.39) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL4805067 0.88 LSS (0.52) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL4805073 0.88 LSS (0.52) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL4799618 0.88 LSS (0.52) LMNASMN1; SMN2HTTMEN1KMT2A

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-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed