SCHEMBL13450335

SCHEMBL13450335

CC1CCN(C(=O)Nc2ccc(N(C)C)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.68
▸ KMT2A Q03164 2/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.68
▸ TP53 P04637 1/20 0.68
▸ GAA P10253 1/20 0.68
▸ ESR2 Q92731 1/20 0.68
▸ LMNA P02545 3/20 0.62
▸ EPHX2 P34913 1/20 0.60
▸ MAPT P10636 3/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ THRB P10828 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ CNR2 P34972 1/20 0.53
▸ NAMPT P43490 2/20 0.52

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
SCHEMBL21698459 0.85 KMT2A (0.62) MEN1KMT2ASMN1; SMN2TP53GAA
SCHEMBL4560026 0.84 KMT2A (0.75) MEN1KMT2ASMN1; SMN2TP53GAA
SCHEMBL312513 0.84 SMN1; SMN2 (0.75) MEN1KMT2ASMN1; SMN2TP53GAA
SCHEMBL12994636 0.83 TSHR (0.71) KMT2ASMN1; SMN2TP53LMNAEPHX2
SCHEMBL11837576 0.82 ALOX5 (0.69) KMT2ASMN1; SMN2TP53GAALMNA
SCHEMBL11839197 0.82 SMN1; SMN2 (0.68) KMT2ASMN1; SMN2GAALMNAEPHX2
SCHEMBL11833345 0.81 LMNA (0.79) SMN1; SMN2TP53LMNAEPHX2MAPT
SCHEMBL12668447 0.81 LMNA (0.64) MEN1KMT2ASMN1; SMN2LMNAEPHX2
SCHEMBL14413882 0.79 ALDH1A1 (0.64) MEN1KMT2ASMN1; SMN2LMNAEPHX2
SCHEMBL14393776 0.78 EPHX2 (0.70) KMT2ASMN1; SMN2LMNAEPHX2MAPT

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
EP-1773796-B1 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-03-03 — — EP disclosed
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