SCHEMBL30994477

SCHEMBL30994477

COCOc1cc(C)cc(C(C)=O)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ BRD2 P25440 1/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ GRM5 P41594 1/20 0.36
▸ HPGD P15428 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
SCHEMBL9679974 0.89 LMNA (0.42) MAOBALDH1A1BRD4BRD2CREBBP
SCHEMBL10252855 0.85 SLC7A5 (0.46) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL6154771 0.84 MEN1 (0.45) ALDH1A1CYP3A4SMN1; SMN2LMNAMEN1
SCHEMBL12526802 0.83 L3MBTL1 (0.46) MAOBALDH1A1KMT2AL3MBTL1NPC1
SCHEMBL28494202 0.83 CA5A (0.53) MAOBLMNAL3MBTL1
SCHEMBL12020820 0.80 LMNA (0.48) ALDH1A1CYP3A4SMN1; SMN2LMNAMEN1
SCHEMBL2978585 0.79 ALDH1A1 (0.39) ALDH1A1CYP3A4SMN1; SMN2LMNAPOLB
SCHEMBL8751846 0.79 KMT2A (0.36) MAOBALDH1A1CYP3A4LMNAMEN1
SCHEMBL13678481 0.78 MAPT (0.44) MAOBALDH1A1BRD4BRD2CREBBP
SCHEMBL12128139 0.78 SMN1; SMN2 (0.34) ALDH1A1CYP1A2CYP3A4SMN1; SMN2LMNA

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
EP-4656635-A1 SUBSTITUTED BENZENE COMPOUND Daiichi Sankyo Company, Limited (JP) 2025-12-03 — — EP disclosed
WO-2024157953-A1 SUBSTITUTED BENZENE COMPOUND 第一三共株式会社 2024-08-02 — — WO disclosed
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