SCHEMBL8089904

SCHEMBL8089904

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

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 4/20 0.47
GAA P10253 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
HTT P42858 3/20 0.46
HPGD P15428 2/20 0.46
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ACVR1 Q04771 1/20 0.45
METAP1 P53582 1/20 0.45
IDE P14735 1/20 0.45
MAPK1 P28482 1/20 0.42
FAAH O00519 1/20 0.42
MGLL Q99685 1/20 0.42

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
SCHEMBL8084112 0.91 MAPT (0.48) LMNASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL8084897 0.91 LMNA (0.42) LMNASMN1; SMN2MAPTGAAKDM4E
SCHEMBL8084125 0.90 TNKS (0.46) LMNASMN1; SMN2MEN1KMT2ANPSR1
SCHEMBL8084141 0.89 SMN1; SMN2 (0.40) LMNASMN1; SMN2MAPTGAAKDM4E
SCHEMBL8084115 0.89 MEN1 (0.45) LMNASMN1; SMN2MAPTGAAKDM4E
SCHEMBL8084900 0.89 SMN1; SMN2 (0.46) LMNASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8084676 0.88 CCNC (0.46) LMNASMN1; SMN2MAPTGAAKDM4E
SCHEMBL8084719 0.88 ALOX15 (0.49) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL8084656 0.87 SMN1; SMN2 (0.39) LMNASMN1; SMN2MAPTGAAKDM4E
SCHEMBL8088254 0.86 ADRA2A (0.51) LMNASMN1; SMN2MAPTKDM4EALDH1A1

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