SCHEMBL30108286

SCHEMBL30108286

C=Cc1cnc(C(=O)NC)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
APEX1 P27695 1/20 0.41
CYP2C19 P33261 1/20 0.41
THPO P40225 1/20 0.41
PMP22 Q01453 1/20 0.41
BAZ2B Q9UIF8 1/20 0.40
ABL1 P00519 1/20 0.39

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
SCHEMBL30108322 0.85 MAPT (0.42) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL15417779 0.82 NPC1 (0.47) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL23618778 0.76 UHRF1 (0.47) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL30992044 0.76 UHRF1 (0.47) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL1459777 0.76 NPC1 (0.43) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL31593230 0.75 PDCD1 (0.59)
SCHEMBL22780037 0.75 PDCD1 (0.59)
SCHEMBL17553883 0.75 NOS3 (0.49) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL15417325 0.75 RAB9A (0.42) MAPTNPC1RAB9AKDM4EHPGD
SCHEMBL23343417 0.72 MAPT (0.43) MAPTNPC1RAB9AKDM4EHPGD

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-113549068-B Novel imidazopyridine compound, preparation method and medical application thereof 上海拓界生物医药科技有限公司 2022-12-02 CN disclosed