SCHEMBL31353026

SCHEMBL31353026

O=Cc1ccc(CCCO)o1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.68
TSHR P16473 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.39
HTT P42858 1/20 0.39
GAA P10253 1/20 0.38
KDM4E B2RXH2 7/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
LDHA P00338 1/20 0.35
LDHB P07195 1/20 0.35
HAO1 Q9UJM8 1/20 0.35
MAPT P10636 4/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
EPHX2 P34913 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL31353027 1.00 ALDH1A1 (0.68) ALDH1A1TSHRL3MBTL1HTTGAA
SCHEMBL10921009 0.94 ALDH1A1 (0.66) ALDH1A1TSHRL3MBTL1HTTGAA
SCHEMBL6840977 0.92 ALDH1A1 (0.63) ALDH1A1TSHRL3MBTL1HTTGAA
SCHEMBL3440182 0.88 ALDH1A1 (0.73) ALDH1A1TSHRL3MBTL1HTTGAA
Aes-103 SCHEMBL31307749 0.81
SCHEMBL17537578 0.80 ALDH1A1 (0.41) ALDH1A1TSHRHTTKDM4ETDP1
SCHEMBL8635202 0.80 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1HTTGAA
SCHEMBL17537833 0.79 ALDH1A1 (0.56) ALDH1A1TSHRL3MBTL1HTTKDM4E
Aes-103 SCHEMBL17872171 0.79 ALDH1A1 (0.96) ALDH1A1TSHRL3MBTL1HTTGAA
Aes-103 SCHEMBL1248422 0.79 ALDH1A1 (0.96) ALDH1A1TSHRL3MBTL1HTTGAA

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-119390732-A Phosphorus-nitrogen synergistic flame-retardant biomass flame retardant and application thereof 常州大学 2025-02-07 CN disclosed