SCHEMBL31470944

SCHEMBL31470944

Cc1cccc(C2=NC(c3ccccc3)C(c3ccccc3)O2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 1/20 0.44
USP1 O94782 1/20 0.41
WDR48 Q8TAF3 1/20 0.41
MAOB P27338 1/20 0.39
EPHX1 P07099 2/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 2/20 0.37
MAPT P10636 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
GLA P06280 1/20 0.37
HSD11B1 P28845 2/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 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
SCHEMBL31470950 1.00 NPC1 (0.44) NPC1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL15165058 0.87 NPC1 (0.43) NPC1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL31470942 0.83 MMP1 (0.45) NPC1RAB9AHPGDSMN1; SMN2USP1
SCHEMBL31470941 0.83 MMP1 (0.45) NPC1RAB9AHPGDSMN1; SMN2USP1
SCHEMBL31470945 0.81 NPC1 (0.45) NPC1RAB9AHPGDSMN1; SMN2MEN1
SCHEMBL15165056 0.78 HPGD (0.36) NPC1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL31470940 0.73 USP1 (0.57) HPGDUSP1WDR48MAOBEPHX1
SCHEMBL31249604 0.73 CCR1 (0.44) NPC1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL14154742 0.72 CYP1A2 (0.45) RAB9ASMN1; SMN2TSHRUSP1WDR48
SCHEMBL18367743 0.72 CYP1A2 (0.45) RAB9ASMN1; SMN2TSHRUSP1WDR48

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-119571341-A Synthetic method of oxazoline compound 柳州职业技术大学 2025-03-07 CN disclosed