SCHEMBL7259705

SCHEMBL7259705

N#Cc1ccc(Cc2ncc(CNc3ccc(-c4ccc(C(=O)N5CCCCC5)o4)cc3)[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
UTS2R Q9UKP6 1/20 0.40
BRS3 P32247 1/20 0.39
SCN10A Q9Y5Y9 3/20 0.39
SCN5A Q14524 2/20 0.39
SCN2A Q99250 2/20 0.39
CDK1 P06493 1/20 0.37
KCNH2 Q12809 1/20 0.37
DGAT2 Q96PD7 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
KDM1A O60341 1/20 0.36
CACNA1H O95180 1/20 0.36

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
SCHEMBL7260652 0.92 UTS2R (0.39) NPC1RAB9AUTS2RBRS3SCN10A
SCHEMBL7260727 0.85 BRS3 (0.42) NPC1RAB9AHPGDUTS2RBRS3
SCHEMBL7259726 0.85 MKNK1 (0.40) BRS3CDK1DGAT2MKNK1MKNK2
SCHEMBL7255190 0.74 FNTA (0.49)
SCHEMBL7461594 0.73 BRS3 (0.48) BRS3
SCHEMBL6983035 0.73 MAPT (0.43) ALDH1A1LMNAMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL8004159 0.72 BRS3 (0.48) BRS3
SCHEMBL6601124 0.71 CCNC (0.39) BRS3DGAT2
SCHEMBL7258832 0.71 MAPKAPK2 (0.41) UTS2RKCNH2KDM1AMAPKAPK2
SCHEMBL7255082 0.70 FNTA (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003099812-A1 PHENYL-FURAN OR PHENYL-THIOPHENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 2003-12-04 WO disclosed