SCHEMBL29766498

SCHEMBL29766498

CCOC(=O)c1cc(C(=O)c2ccc3ccccc3c2)n2ccc(C(=O)c3ccccc3)cc12

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.56
▸ FNTA P49354 11/20 0.51
▸ FNTB P49356 11/20 0.51
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HPGD P15428 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ ACHE P22303 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ NOD2 Q9HC29 1/20 0.40
▸ NOD1 Q9Y239 1/20 0.40
▸ GMNN O75496 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL26829993 0.82 ALDH1A1 (0.57) ALDH1A1FNTAFNTBMEN1KMT2A
SCHEMBL26830001 0.76 ALDH1A1 (0.54) ALDH1A1FNTAFNTBHPGDKDM4E
SCHEMBL27211503 0.74 BCHE (0.52) ALDH1A1FNTAFNTBMEN1KMT2A
SCHEMBL26829996 0.74 ALDH1A1 (0.52) ALDH1A1FNTAFNTBKDM4ENPSR1
SCHEMBL26829999 0.74 ALDH1A1 (0.52) ALDH1A1FNTAFNTBMEN1KMT2A
SCHEMBL26829994 0.74 ALDH1A1 (0.52) ALDH1A1FNTAFNTBMEN1KMT2A
SCHEMBL27211444 0.73 ALDH1A1 (0.51) ALDH1A1FNTAFNTBMEN1KMT2A
SCHEMBL27211499 0.73 FNTA (0.52) ALDH1A1FNTAFNTBHPGDKDM4E
SCHEMBL27211517 0.73 FNTA (0.52) ALDH1A1FNTAFNTBMEN1KMT2A
SCHEMBL571295 0.71 CA12 (0.59) ALDH1A1MEN1KMT2AHPGDKDM4E

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
US-11692112-B2 Low temperature vibration damping pressure sensitive adhesives and constructions 3M INNOVATIVE PROPERTIES COMPANY (US) 2023-07-04 — — US disclosed
CN-114724379-A Data processing method, device, equipment and storage medium 中汽创智科技有限公司 2022-07-08 — — CN disclosed
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