SCHEMBL26599434

SCHEMBL26599434

CC(C)(C)c1ccc(Nc2ccc3c(c2)sc2ccccc23)c(-c2ccccc2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.37
▸ KIF11 P52732 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PRSS12 P56730 2/20 0.35
▸ KCNK18 Q7Z418 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ PTGIR P43119 1/20 0.34
▸ GPR3 P46089 1/20 0.33
▸ PTPN7 P35236 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ PTPN12 Q05209 1/20 0.33
▸ PTPN22 Q9Y2R2 1/20 0.33
▸ AKR1C3 P42330 1/20 0.32
▸ AKR1C2 P52895 1/20 0.32
▸ TNKS O95271 2/20 0.32
▸ TNKS2 Q9H2K2 2/20 0.32

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
SCHEMBL30363442 1.00 ABCG2 (0.37) ABCG2KIF11ALDH1A1RAB9AMAPT
SCHEMBL22938123 0.93 PTGIR (0.41) ABCG2KIF11ALDH1A1RAB9AMAPT
SCHEMBL30363256 0.93 PTGIR (0.41) ABCG2KIF11ALDH1A1RAB9AMAPT
SCHEMBL26599205 0.84 CYP26A1 (0.31) ABCG2KIF11KCNK18
SCHEMBL17363312 0.82 MAPT (0.42) ALDH1A1RAB9AMAPTHPGDSMN1; SMN2
SCHEMBL23422113 0.81 PARP14 (0.40) ABCG2KIF11ALDH1A1RAB9AMAPT
SCHEMBL24374072 0.81 MAPT (0.41) ALDH1A1RAB9AMAPTHPGDSMN1; SMN2
SCHEMBL28667623 0.81 ALDH1A1 (0.44) ABCG2KIF11ALDH1A1RAB9AMAPT
SCHEMBL23118189 0.80 AKR1C3 (0.46) ABCG2ALDH1A1RAB9AMAPTKCNK18
SCHEMBL30503054 0.80 AKR1C3 (0.46) ABCG2ALDH1A1RAB9AMAPTKCNK18

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
US-20250268015-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2025-08-21 — — US 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
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