SCHEMBL8084656

SCHEMBL8084656

C=COC(=O)N1CCN(c2ccc(C(=O)CSc3ccnc4ccccc34)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.39
ALDH1A1 P00352 5/20 0.39
LMNA P02545 4/20 0.39
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
POLB P06746 1/20 0.39
HSD17B10 Q99714 2/20 0.37
MITF O75030 1/20 0.37
RAD52 P43351 1/20 0.37
CHRM1 P11229 1/20 0.36
GAA P10253 1/20 0.36
KCNH2 Q12809 1/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL8084115 0.89 MEN1 (0.45) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8084112 0.88 MAPT (0.48) SMN1; SMN2ALDH1A1LMNADRD2DRD3
SCHEMBL8089904 0.87 LMNA (0.51) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8084719 0.86 ALOX15 (0.49) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8084900 0.85 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNANPSR1MAPT
SCHEMBL8084676 0.85 CCNC (0.46) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8084125 0.85 TNKS (0.46) SMN1; SMN2LMNANPSR1POLBMEN1
SCHEMBL8084141 0.84 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8084897 0.84 LMNA (0.42) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8084826 0.83 NPC1 (0.50) SMN1; SMN2ALDH1A1LMNAKDM4ENPSR1

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
US-6057447-A BACTERICIDES FOR CAMPYLOBACTER ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2000-05-02 US disclosed
EP-0926139-A1 QUINOLINE SULFIDE DERIVATIVES ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-06-30 EP disclosed