SCHEMBL31441069

SCHEMBL31441069

CCCCCCCCCCCCCCCCOc1ccc(-c2ccc(CO)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.62
NR5A1 Q13285 1/20 0.61
CYP3A4 P08684 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
USP2 O75604 1/20 0.55
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.55
CASP1 P29466 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SLCO1B3 Q9NPD5 1/20 0.55
SLCO1B1 Q9Y6L6 1/20 0.55
CYP2D6 P10635 1/20 0.54
TP53 P04637 2/20 0.54
TSHR P16473 1/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
GAA P10253 1/20 0.54
LTA4H P09960 1/20 0.53

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
SCHEMBL8544647 1.00 RARB (0.62) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL8532280 1.00 RARB (0.62) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL8607625 1.00 RARB (0.62) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL19491273 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL3058202 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL10427931 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL9665213 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL14546295 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL3051144 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A
SCHEMBL728423 0.95 NR5A1 (0.67) RARBNR5A1CYP3A4MEN1KMT2A

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-119735552-A Synthesis method of N-acetyl-L-carnosine 甘肃瑞德林生物有限公司 2025-04-01 CN disclosed