SCHEMBL6948964

SCHEMBL6948964

CCOC(=O)c1cccc2nc(CCc3ccc(OCc4ccccc4)cc3)[nH]c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
HSP90AA1 P07900 1/20 0.52
KMT2A Q03164 1/20 0.52
NMT1 P30419 4/20 0.47
NMT2 O60551 1/20 0.47
HPGD P15428 1/20 0.47
GABRA1 P14867 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
GABRA2 P47869 1/20 0.46
MAOB P27338 1/20 0.46
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 1/20 0.44
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL6942891 0.91 MAPT (0.47) MEN1HSP90AA1KMT2ASMN1; SMN2MAPT
SCHEMBL6948278 0.89 PRMT5 (0.45) MEN1HSP90AA1KMT2AHPGDGABRA1
SCHEMBL6952578 0.88 DHODH (0.52) LTB4RLTB4R2FFAR1FFAR4DHODH
SCHEMBL6948956 0.84 DHODH (0.54) MEN1HSP90AA1KMT2AHPGDGABRA1
SCHEMBL6949863 0.81 SCN1A (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2MAPT
SCHEMBL6945413 0.81 LMNA (0.45) KMT2AHPGDSMN1; SMN2MAPTLMNA
SCHEMBL6949850 0.79 MAPT (0.49) MEN1KMT2AMAPTLMNA
SCHEMBL6953656 0.78 MAPT (0.44) MEN1KMT2AHPGDSMN1; SMN2MAPT
SCHEMBL6945589 0.76 TUBB4A (0.46) MEN1HSP90AA1KMT2ASMN1; SMN2MAPT
SCHEMBL6945368 0.76 RAB9A (0.52) SMN1; SMN2MAPT

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