SCHEMBL8084897

SCHEMBL8084897

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ACVR1 Q04771 1/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 2/20 0.39
TSHR P16473 2/20 0.39
CASP1 P29466 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RORC P51449 1/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
METAP1 P53582 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL8089904 0.91 LMNA (0.51) LMNASMN1; SMN2ACVR1MAPTALDH1A1
SCHEMBL8084112 0.88 MAPT (0.48) LMNASMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL8084125 0.87 TNKS (0.46) LMNASMN1; SMN2HRH2HRH1NPSR1
SCHEMBL8084141 0.86 SMN1; SMN2 (0.40) LMNASMN1; SMN2ACVR1MAPTALDH1A1
SCHEMBL8084115 0.86 MEN1 (0.45) LMNASMN1; SMN2ACVR1MAPTALDH1A1
SCHEMBL8084900 0.86 SMN1; SMN2 (0.46) LMNASMN1; SMN2MAPTALDH1A1TSHR
SCHEMBL8084676 0.85 CCNC (0.46) LMNASMN1; SMN2MAPTALDH1A1TSHR
SCHEMBL8084719 0.85 ALOX15 (0.49) LMNASMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL8084819 0.84 ALDH1A1 (0.43) LMNASMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL8084656 0.84 SMN1; SMN2 (0.39) LMNASMN1; SMN2MAPTALDH1A1HPGD

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