SCHEMBL29149140

SCHEMBL29149140

CC(C)c1c(O)cc(-c2cc3ccccc3o2)c(F)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.43
▸ ABCB1 P08183 1/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ MAOB P27338 2/20 0.42
▸ MAOA P21397 1/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ PDE4D Q08499 1/20 0.39
▸ TYR P14679 1/20 0.38
▸ DAO P14920 1/20 0.38
▸ AKR1B1 P15121 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ TOP2A P11388 1/20 0.38
▸ PTPRC P08575 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ ERN1 O75460 1/20 0.37
▸ MKNK1 Q9BUB5 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
SCHEMBL30730424 1.00 ALOX5 (0.43) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL29114159 0.83 AKR1C3 (0.56) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL30626963 0.83 AKR1C3 (0.56) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL29149149 0.77 ALOX5 (0.62) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL30730417 0.77 ALOX5 (0.62) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL29149155 0.77 ALOX5 (0.55) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL30730459 0.77 ALOX5 (0.55) ALOX5ABCB1KMT2AMEN1TDP1
SCHEMBL29149091 0.74 TUBB4A (0.44) ALOX5KMT2AMAOBMAOAHPGD
SCHEMBL30730423 0.74 TUBB4A (0.44) ALOX5KMT2AMAOBMAOAHPGD
SCHEMBL29114161 0.73 AKR1C3 (0.58) ALOX5ABCB1KMT2AMEN1TDP1

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
WO-2025082312-A1 AROMATIC HYDROCARBON RECEPTOR MODULATOR COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 德明药泰生物技术(深圳)有限公司 2025-04-24 — — WO disclosed
CN-117447402-A Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof 德明药泰生物技术(深圳)有限公司 2024-01-26 — — CN disclosed
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