SCHEMBL7204675

SCHEMBL7204675

CNCCCCO[C@H]1CC[C@H](N(C)C(=S)Nc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CARM1 Q86X55 1/20 0.39
▸ PRMT6 Q96LA8 1/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ KCNH2 Q12809 1/20 0.38
▸ GPR119 Q8TDV5 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ CDK1 P06493 1/20 0.36
▸ ADRB2 P07550 1/20 0.35
▸ ADRB1 P08588 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ USP30 Q70CQ3 2/20 0.35
▸ RAB9A P51151 1/20 0.33
▸ DHODH Q02127 1/20 0.33

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
SCHEMBL7204672 1.00 LMNA (0.40) LMNAMAPTCARM1PRMT6MEN1
SCHEMBL7208983 0.99 LMNA (0.40) LMNAMAPTCARM1PRMT6MEN1
SCHEMBL7208986 0.99 LMNA (0.40) LMNAMAPTCARM1PRMT6MEN1
SCHEMBL7204439 0.85 LMNA (0.40) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7204442 0.85 LMNA (0.40) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7208602 0.84 LMNA (0.41) LMNAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL7208600 0.84 LMNA (0.41) LMNAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL7210604 0.84 LMNA (0.39) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7210601 0.84 LMNA (0.39) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7208794 0.83 LMNA (0.42) LMNAMAPTMEN1KMT2ASMN1; SMN2

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
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