SCHEMBL24442807

SCHEMBL24442807

CC1(C)CCC(C)(C)c2cc(-c3ccccc3)c(Nc3ccccc3)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 9/20 0.43
▸ RXRA P19793 7/20 0.43
▸ RARG P13631 6/20 0.43
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ CYP3A4 P08684 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ EGFR P00533 2/20 0.39
▸ SRC P12931 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ GLA P06280 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ RGS12 O14924 1/20 0.39
▸ GMNN O75496 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL29945232 0.90 RARB (0.46) RARBRXRARARGMEN1KMT2A
SCHEMBL23442800 0.90 RARB (0.46) RARBRXRARARGMEN1KMT2A
SCHEMBL23442477 0.89 NPSR1 (0.47) RARBRXRARARGMEN1KMT2A
SCHEMBL23118193 0.88 ABCG2 (0.39) RARBRXRARARGMEN1KMT2A
SCHEMBL24442968 0.82 RARB (0.39) RARBRXRARARGRXRBRXRG
SCHEMBL23446728 0.82 RARB (0.39) RARBRXRARARGRXRBRXRG
SCHEMBL26951708 0.79 RARB (0.46) RARBRXRARARGRXRBRXRG
SCHEMBL24562676 0.79 RXRA (0.42) RARBRXRARARGMEN1KMT2A
SCHEMBL26952491 0.78 RARB (0.47) RARBRXRARARGMEN1KMT2A
SCHEMBL26951637 0.78 RARB (0.47) RARBRXRARARGMEN1KMT2A

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
WO-2022103090-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-05-19 — — WO disclosed
WO-2022103090-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-05-19 — — WO disclosed
Send feedback