SCHEMBL31287285

SCHEMBL31287285

NC(=O)C1CCCCCCN=N1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.34
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
EPHX2 P34913 1/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
ALOX5 P09917 1/20 0.31

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
SCHEMBL30719666 1.00 EPHX1 (0.34) EPHX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL28716310 1.00 EPHX1 (0.34) EPHX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL6102995 0.91
SCHEMBL9412302 0.82
SCHEMBL28707168 0.81 EPHX1 (0.33) EPHX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL9020413 0.78 EPHX1 (0.37) EPHX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL8820682 0.77 EPHX1 (0.31) EPHX1
SCHEMBL5160612 0.76
SCHEMBL5456 0.76
SCHEMBL28615639 0.75 POLB (0.38) EPHX1NPC1RAB9ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119462659-A Bridged tricyclic carbamoyl pyridone compounds and pharmaceutical uses thereof 吉利德科学公司 2025-02-18 CN disclosed
CN-113874079-B Bridged tricyclic carbamoyl pyridone compounds and pharmaceutical uses thereof 吉利德科学公司 2024-11-08 CN disclosed