SCHEMBL26599205

SCHEMBL26599205

CC(C)(C)c1ccc(Nc2ccc3c(c2)sc2cc4c(cc23)C(C)(C)CCC4(C)C)c(-c2ccccc2)c1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 2/20 0.31
▸ CYP26B1 Q9NR63 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.30
▸ KIF11 P52732 1/20 0.30
▸ RARB P10826 1/20 0.30
▸ RARG P13631 1/20 0.30
▸ RXRA P19793 1/20 0.30
▸ KCNK18 Q7Z418 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
SCHEMBL26599434 0.84 ABCG2 (0.37) ABCG2KIF11KCNK18
SCHEMBL30363442 0.84 ABCG2 (0.37) ABCG2KIF11KCNK18
SCHEMBL22934074 0.84 CYP26A1 (0.40) CYP26A1CYP26B1PTGS1PTGS2ABCG2
SCHEMBL31069371 0.83 ABCG2 (0.30) ABCG2
SCHEMBL23439459 0.83 ABCG2 (0.30) ABCG2
SCHEMBL31069428 0.82 ALDH1A1 (0.31) CYP26A1CYP26B1PTGS1PTGS2ABCG2
SCHEMBL23439377 0.82 ALDH1A1 (0.31) CYP26A1CYP26B1PTGS1PTGS2ABCG2
SCHEMBL23442475 0.81 RXRA (0.32) RARBRARGRXRA
SCHEMBL23439063 0.80 ALDH1A1 (0.33) CYP26A1CYP26B1PTGS1PTGS2ABCG2
SCHEMBL31069376 0.80 ALDH1A1 (0.33) CYP26A1CYP26B1PTGS1PTGS2ABCG2

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-4265624-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-10-25 — — EP disclosed
EP-4265624-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-10-25 — — EP disclosed
WO-2022139513-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-30 — — WO disclosed
Send feedback