SCHEMBL6023317

SCHEMBL6023317

CCCCCCCCCCCCOc1ccc([CH]CCc2ccc(Cl)c(Cl)c2)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
GLA P06280 1/20 0.44
GPR84 Q9NQS5 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CNR1 P21554 2/20 0.39
CNR2 P34972 2/20 0.39
HTT P42858 1/20 0.39
GCGR P47871 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
KCNA3 P22001 1/20 0.38
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38

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
SCHEMBL6023318 0.81 SMN1; SMN2 (0.46) SMN1; SMN2GLAGPR84MEN1KMT2A
SCHEMBL1854400 0.77 SLC2A1 (0.57) SMN1; SMN2GLAKMT2AGCGRSIGMAR1
SCHEMBL9398842 0.73 SMN1; SMN2 (0.70) SMN1; SMN2GLAMEN1KMT2AHTT
SCHEMBL29802338 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT
SCHEMBL29802558 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT
SCHEMBL23271675 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT
SCHEMBL19612290 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT
SCHEMBL29802382 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT
SCHEMBL23271677 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT
SCHEMBL30630917 0.72 CNR1 (0.61) MEN1KMT2ACNR1CNR2HTT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732534-A1 USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS Applied Research Systems ARS Holding N.V. (AN) 2006-12-20 EP claimed
WO-2005082347-A1 USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS APLLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-09-09 WO claimed
EP-1470102-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-10-27 EP claimed
WO-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 WO claimed