SCHEMBL28301055

SCHEMBL28301055

COCCOCn1c(C(=O)OCl)nc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.46
KDM4E B2RXH2 7/20 0.44
ALDH1A1 P00352 5/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
PKM P14618 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
HPGD P15428 1/20 0.42
POLB P06746 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 3/20 0.42
TSPO P30536 1/20 0.42
RECQL P46063 1/20 0.41
DRD2 P14416 1/20 0.41
TBXA2R P21731 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL18395333 0.76 KDM4E (0.56) SMN1; SMN2KDM4EALDH1A1NPC1RAB9A
SCHEMBL9670397 0.74 KDM4E (0.57) SMN1; SMN2KDM4EALDH1A1NPC1RAB9A
SCHEMBL16792476 0.74 KDM4E (0.51) SMN1; SMN2KDM4EALDH1A1NPC1RAB9A
SCHEMBL19523362 0.73 KDM4E (0.50) SMN1; SMN2KDM4EALDH1A1RAB9AHPGD
SCHEMBL5953265 0.72 KDM4E (0.55) SMN1; SMN2KDM4EALDH1A1NPC1HPGD
SCHEMBL22113999 0.72 KDM4E (0.54) SMN1; SMN2KDM4EALDH1A1NPC1HPGD
SCHEMBL30497266 0.71 HPGD (0.62) SMN1; SMN2KDM4EALDH1A1NPC1RAB9A
SCHEMBL4784069 0.70 CYP2C19 (0.60) SMN1; SMN2KDM4EPOLBLMNATSPO
SCHEMBL22075813 0.70 NPC1 (0.44) SMN1; SMN2KDM4EALDH1A1NPC1POLB
SCHEMBL22113991 0.69 ALDH1A1 (0.43) SMN1; SMN2KDM4EALDH1A1NPC1POLB

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
CN-105622580-B Benzimidazole as prolyl hydroxylase inhibitors 詹森药业有限公司 2019-06-21 CN disclosed