SCHEMBL30228133

SCHEMBL30228133

Cc1ccccc1-c1cc(=O)oc2cc(C(C)CC(=O)N3CCCCC3)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 1/20 0.42
▸ POLB P06746 5/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ RECQL P46063 3/20 0.42
▸ CTDSP1 Q9GZU7 2/20 0.42
▸ PABPC1 P11940 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ APOBEC3A P31941 1/20 0.42
▸ EIF4H Q15056 1/20 0.42
▸ APOBEC3G Q9HC16 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL31711268 0.89 ALDH1A1 (0.50) KCNA3POLBKDM4ETDP1CTDSP1
SCHEMBL30228467 0.89 ALDH1A1 (0.50) KCNA3POLBKDM4ETDP1CTDSP1
SCHEMBL31710963 0.89 ALDH1A1 (0.50) KCNA3POLBKDM4ETDP1CTDSP1
SCHEMBL30228046 0.89 ALDH1A1 (0.50) KCNA3POLBKDM4ETDP1CTDSP1
SCHEMBL30228062 0.87 ALDH1A1 (0.61) POLBKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL30228407 0.84 KCNA3 (0.48) KCNA3KDM4ERECQLHPGDALDH1A1
SCHEMBL30227980 0.82 NPC1 (0.45) KCNA3TDP1HPGDALDH1A1SMN1; SMN2
SCHEMBL30228280 0.80 CHRM2 (0.51) KCNA3TDP1HPGDALDH1A1SMN1; SMN2
SCHEMBL30228272 0.80 CHRM2 (0.51) KCNA3TDP1HPGDALDH1A1SMN1; SMN2
SCHEMBL30228032 0.79 PLA2G7 (0.62) KCNA3POLBRECQLHPGDALDH1A1

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
WO-2023034346-A1 CHROMEN-2-ONE MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
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