SCHEMBL3353952

SCHEMBL3353952

Cc1cc2ccc(N)cc2n1C1CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GFER P55789 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALOX15 P16050 1/20 0.37
CDC7 O00311 1/20 0.37
HRH4 Q9H3N8 2/20 0.36
BRPF1 P55201 2/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36
PRKCI P41743 1/20 0.36
RAD52 P43351 1/20 0.35
ADRA2C P18825 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
SCHEMBL8531640 0.83 HTR2A (0.43) KDM4EALDH1A1SMN1; SMN2ALOX15OPRM1
SCHEMBL3352228 0.77 HTR7 (0.44) MAPTALDH1A1HRH4OPRM1OPRL1
SCHEMBL21983722 0.77 HTR6 (0.34) MAPTCYP11B1CYP11B2
SCHEMBL3351951 0.76 NOTUM (0.40) KDM4EALDH1A1HTR1DHTR1BHRH4
SCHEMBL13841063 0.75 OPRM1 (0.34) OPRM1OPRL1OPRD1OPRK1
SCHEMBL3352865 0.75 HTR1D (0.51) HTR1DHTR1BGAASMN1; SMN2OPRM1
SCHEMBL21983714 0.73 CYP11B2 (0.43) MAPTALDH1A1TDP1CYP11B1CYP11B2
SCHEMBL3349663 0.72 HTR1B (0.54) HTR1DHTR1BGAASMN1; SMN2ALOX15
SCHEMBL30594683 0.72 PRKCI (0.51) HTR1DHTR1BGAASMN1; SMN2BRPF1
SCHEMBL2266494 0.72 PRKCI (0.51) HTR1DHTR1BGAASMN1; SMN2BRPF1

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-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed