SCHEMBL25856302

SCHEMBL25856302

CCc1cc(NC(=O)OCc2ccccc2)ccc1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
TP53 P04637 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
ALDH1A1 P00352 1/20 0.60
TSHR P16473 1/20 0.60
ATM Q13315 1/20 0.60
MGLL Q99685 2/20 0.59
POLB P06746 1/20 0.55
ENPP2 Q13822 3/20 0.53
ROCK2 O75116 1/20 0.52
SCD O00767 1/20 0.51
KDM1A O60341 1/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
PTPN1 P18031 1/20 0.50
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL11766069 0.85 NPC1 (0.72) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL12325529 0.84 MGLL (0.59) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL12583048 0.84 NPC1 (0.62) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL591401 0.84 MGLL (0.59) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL24423488 0.83 MGLL (0.58) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL3175561 0.82 MGLL (0.60) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL17813398 0.82 NPC1 (0.50) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL17927947 0.82 MGLL (0.72) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL12465253 0.82 MGLL (0.56) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL29954425 0.82 MGLL (0.56) MAPTNPC1RAB9ATP53SMN1; SMN2

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-2023133943-A1 CROSS-LINKED POLYAMIC ACID ESTER AND PREPARATION METHOD THEREFOR, POLYIMIDE COMPOSITION COMPRISING SAME, AND METHOD FOR PREPARING POLYIMIDE RESIN FILM 深圳职业技术学院 2023-07-20 WO disclosed