SCHEMBL7208983

SCHEMBL7208983

CNCCCCCCOC1CCC(N(C)C(=S)Nc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

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
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ GPR119 Q8TDV5 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CDK1 P06493 1/20 0.36
▸ ADRB2 P07550 1/20 0.35
▸ ADRB1 P08588 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ USP30 Q70CQ3 2/20 0.34
▸ LSS P48449 1/20 0.33
▸ EPHX2 P34913 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
SCHEMBL7208986 1.00 LMNA (0.40) LMNAMAPTCARM1PRMT6SMN1; SMN2
SCHEMBL7204675 0.99 LMNA (0.40) LMNAMAPTCARM1PRMT6SMN1; SMN2
SCHEMBL7204672 0.99 LMNA (0.40) LMNAMAPTCARM1PRMT6SMN1; SMN2
SCHEMBL7208602 0.85 LMNA (0.41) LMNAMAPTSMN1; SMN2MEN1HTT
SCHEMBL7208600 0.85 LMNA (0.41) LMNAMAPTSMN1; SMN2MEN1HTT
SCHEMBL7210604 0.85 LMNA (0.39) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7210601 0.85 LMNA (0.39) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7204439 0.84 LMNA (0.40) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL7204442 0.84 LMNA (0.40) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL4799620 0.83 LSS (0.52) LMNAMAPTSMN1; SMN2MEN1HTT

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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