SCHEMBL27968882

SCHEMBL27968882

CC(C)COc1cccc(OC(=O)c2cccc(Cl)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ KMT2A Q03164 3/20 0.48
▸ NR1H4 Q96RI1 1/20 0.47
▸ MAOA P21397 2/20 0.46
▸ MAOB P27338 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ KAT6A Q92794 1/20 0.45
▸ NR4A2 P43354 1/20 0.44
▸ FOS P01100 1/20 0.44
▸ JUN P05412 1/20 0.44
▸ ESR1 P03372 1/20 0.44
▸ ESR2 Q92731 1/20 0.44
▸ GAA P10253 1/20 0.43

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
SCHEMBL27968978 0.82 FAAH (0.57) KDM4EUSP2ALDH1A1ALOX15NPSR1
SCHEMBL9967717 0.80 WDR5 (0.50) KDM4EKMT2A
SCHEMBL27968970 0.79 NR4A2 (0.64) KDM4EUSP2ALDH1A1ALOX15NPSR1
SCHEMBL6057293 0.79 CHRM2 (0.55) ALDH1A1HPGDGAA
SCHEMBL26049008 0.77 NR1H4 (0.60) KDM4EUSP2KMT2ANR1H4KAT6A
SCHEMBL30721452 0.77 KDM4E (0.68) KDM4EUSP2ALDH1A1ALOX15NPSR1
SCHEMBL6057189 0.77 KDM4E (0.68) KDM4EUSP2ALDH1A1ALOX15NPSR1
SCHEMBL14335042 0.76 LMNA (0.47) KDM4EUSP2ALDH1A1ALOX15NPSR1
SCHEMBL10626565 0.76 HPGD (0.51) KDM4EUSP2ALDH1A1ALOX15NPSR1
SCHEMBL3248766 0.76 NR1H4 (0.58) USP2ALDH1A1KMT2ANR1H4KAT6A

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-103781805-A Catalyst components for the polymerization of olefins BASELL POLIOLEFINE SRL 2014-05-07 — — CN disclosed
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