SCHEMBL28291406

SCHEMBL28291406

CC(C)Oc1cc[c]cc1C(=O)N1CCN(C)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALOX15 P16050 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ KMT2A Q03164 2/20 0.39
▸ SLC6A9 P48067 3/20 0.39
▸ POLB P06746 3/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ HTT P42858 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ IRAK4 Q9NWZ3 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
SCHEMBL27991292 0.79 L3MBTL1 (0.49) HPGDALDH1A1L3MBTL1ALOX15LMNA
SCHEMBL5497829 0.77 HSP90AA1 (0.50) HPGDALDH1A1L3MBTL1ALOX15LMNA
SCHEMBL182953 0.77 ALDH1A1 (0.54) HPGDALDH1A1L3MBTL1ALOX15LMNA
SCHEMBL4319075 0.75 ALDH1A1 (0.46) HPGDALDH1A1LMNAKMT2AKDM4E
SCHEMBL16463399 0.75 L3MBTL1 (0.48) HPGDALDH1A1L3MBTL1ALOX15LMNA
SCHEMBL28292798 0.74 L3MBTL1 (0.48) HPGDALDH1A1L3MBTL1ALOX15LMNA
SCHEMBL4286287 0.73 IRAK4 (0.42) ALDH1A1LMNATSHRPOLBKDM4E
SCHEMBL27991513 0.72 L3MBTL1 (0.48) HPGDALDH1A1L3MBTL1ALOX15LMNA
SCHEMBL3891455 0.71 DRD2 (0.44) ALDH1A1L3MBTL1KMT2AGAAKDM4E
SCHEMBL17502622 0.69 HTT (0.63) TSHRKMT2AHTTMEN1GAA

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-104350055-B Bicyclic heteroaryl derivatives and application thereof as MNK1 and MNK2 regulator 新加坡科技研究局 2019-05-31 — — CN disclosed
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