SCHEMBL8084115

SCHEMBL8084115

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

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 4/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.40
POLB P06746 1/20 0.40
METAP1 P53582 2/20 0.37
ACVR1 Q04771 1/20 0.37
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
MGLL Q99685 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 2/20 0.35
CHRM1 P11229 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL8084656 0.89 SMN1; SMN2 (0.39) MEN1KMT2ALMNAMAPK1SMN1; SMN2
SCHEMBL8089904 0.89 LMNA (0.51) MEN1KMT2ALMNAMAPK1SMN1; SMN2
SCHEMBL8084125 0.87 TNKS (0.46) MEN1KMT2ALMNARAB9ASMN1; SMN2
SCHEMBL8084112 0.86 MAPT (0.48) KMT2ALMNASMN1; SMN2POLBDRD2
SCHEMBL8084897 0.86 LMNA (0.42) MEN1KMT2ALMNASMN1; SMN2POLB
SCHEMBL8084141 0.86 SMN1; SMN2 (0.40) MEN1KMT2ALMNASMN1; SMN2POLB
SCHEMBL8084719 0.85 ALOX15 (0.49) LMNAMAPK1SMN1; SMN2POLBDRD2
SCHEMBL8084900 0.84 SMN1; SMN2 (0.46) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL8084676 0.83 CCNC (0.46) LMNAMAPK1RAB9ASMN1; SMN2POLB
SCHEMBL8084826 0.81 NPC1 (0.50) LMNARAB9ASMN1; SMN2POLBMETAP1

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