SCHEMBL22682027

SCHEMBL22682027

CN(c1ccc(CO)cc1)c1ccc2c(c1)CCCC2

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.49
▸ RXRB P28702 1/20 0.49
▸ RXRG P48443 1/20 0.49
▸ KDM4C Q9H3R0 1/20 0.43
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ CETP P11597 1/20 0.35

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
SCHEMBL22682095 0.83 RXRA (0.49) RXRARXRBRXRGKDM4CMEN1
SCHEMBL22681736 0.83 RXRA (0.44) RXRARXRBRXRGKDM4C
SCHEMBL22682009 0.82 RXRA (0.43) RXRARXRBRXRGKDM4CMAPT
SCHEMBL17378763 0.81 RXRA (0.46) RXRARXRBRXRGKDM4CMEN1
SCHEMBL13569439 0.81 ALDH1A1 (0.43) RXRARXRBRXRGKDM4CMEN1
SCHEMBL22682020 0.81 KDM6B (0.45) RXRARXRBRXRGKDM4CMAPT
SCHEMBL11310810 0.80 TSHR (0.44) —
SCHEMBL22681849 0.79 CHKA (0.42) RXRARXRBRXRGKDM4C
SCHEMBL22681645 0.79 RXRA (0.41) RXRARXRBRXRGKDM4CMEN1
SCHEMBL22681798 0.79 RXRA (0.43) RXRARXRBRXRGKDM4CMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3160952-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2020-12-02 — — EP disclosed
EP-3741749-A1 HISTONE DEMETHYLASE INHIBITORS Celgene Quanticel Research, Inc. (US) 2020-11-25 — — EP disclosed
EP-3738960-A1 HISTONE DEMETHYLASE INHIBITORS Celgene Quanticel Research, Inc. (US) 2020-11-18 — — EP disclosed
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