SCHEMBL6942891

SCHEMBL6942891

CCOC(=O)c1cccc2nc(CCc3ccccc3)[nH]c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
RAB9A P51151 5/20 0.47
NPC1 O15118 4/20 0.47
TSHR P16473 2/20 0.47
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CLEC4M Q9H2X3 1/20 0.43
MMP2 P08253 1/20 0.43
NTRK1 P04629 1/20 0.42
CDC25B P30305 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 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
SCHEMBL6948964 0.91 MEN1 (0.52) MAPTSMN1; SMN2LMNAMEN1HSP90AA1
SCHEMBL6945413 0.89 LMNA (0.45) MAPTRAB9ANPC1TSHRCYP1A2
SCHEMBL6949863 0.87 SCN1A (0.42) MAPTRAB9ANPC1TSHRCYP1A2
SCHEMBL6949850 0.86 MAPT (0.49) MAPTRAB9ANPC1TSHRHSD17B10
SCHEMBL6945589 0.84 TUBB4A (0.46) MAPTRAB9ANPC1TSHRCYP1A2
SCHEMBL6945368 0.84 RAB9A (0.52) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL6948961 0.83 RAB9A (0.55) MAPTRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL6942886 0.81 PARP1 (0.48) MAPTRAB9ANPC1TSHRCYP1A2
SCHEMBL6945580 0.81 MAPT (0.45) MAPTRAB9ANPC1HSD17B10KDM4E
SCHEMBL6948946 0.80 NPC1 (0.46) MAPTRAB9ANPC1SMN1; SMN2HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0936218-B1 BENZIMIDAZOLE DERIVATIVES MOCHIDA PHARM CO LTD (JP) 2003-04-02 EP disclosed
US-6387938-B1 Benzimidazole derivatives MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-05-14 US disclosed
EP-0936218-A1 NOVEL BENZIMIDAZOLE DERIVATIVES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1999-08-18 EP disclosed