SCHEMBL23439345

SCHEMBL23439345

Cc1cc2c(cc1Nc1cccc3oc4cc5c(cc4c13)C(C)(C)CCC5(C)C)C(C)(C)CCC2(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 7/20 0.33
▸ LMNA P02545 2/20 0.33
▸ RXRB P28702 2/20 0.33
▸ RXRG P48443 2/20 0.33
▸ RARG P13631 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ GNRHR P30968 3/20 0.32
▸ HDAC3 O15379 1/20 0.30
▸ HDAC4 P56524 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC7 Q8WUI4 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC10 Q969S8 1/20 0.30
▸ HDAC11 Q96DB2 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30
▸ HDAC9 Q9UKV0 1/20 0.30

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
SCHEMBL23439372 0.90 ALDH1A1 (0.41) RXRALMNARXRBRXRGALDH1A1
SCHEMBL23439979 0.85 RXRA (0.33) RXRALMNAALDH1A1SMN1; SMN2
SCHEMBL23439359 0.85 CYP26A1 (0.35) RXRALMNAALDH1A1SMN1; SMN2
SCHEMBL23439367 0.84 LMNA (0.35) RXRALMNARXRBRXRGRARG
SCHEMBL23439452 0.79 ALDH1A1 (0.43) LMNAALDH1A1SMN1; SMN2GNRHR
SCHEMBL23438794 0.79 ALDH1A1 (0.36) RXRALMNARXRBRXRGRARG
SCHEMBL23439428 0.79 RXRA (0.34) RXRALMNARXRBRXRGRARG
SCHEMBL23421687 0.77 SMN1; SMN2 (0.41) LMNAALDH1A1SMN1; SMN2
SCHEMBL23927691 0.76 RXRA (0.41) RXRARXRBRXRGRARGRARA
SCHEMBL31069430 0.75 RARB (0.30) RXRARARGRARB

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
WO-2021107711-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — WO disclosed
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