SCHEMBL24727137

SCHEMBL24727137

C1=Cc2c([nH]c3c2ccc2c4ccccc4oc23)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERCC5 P28715 1/20 0.39
▸ FEN1 P39748 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.34
▸ PPARG P37231 3/20 0.34
▸ RXFP1 Q9HBX9 3/20 0.34
▸ NR2E3 Q9Y5X4 3/20 0.34
▸ NCOR2 Q9Y618 3/20 0.34
▸ KDM4E B2RXH2 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ PGR P06401 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ CSF1R P07333 1/20 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
SCHEMBL28672386 0.87 ERCC5 (0.44) ERCC5FEN1ALDH1A1PPARGRXFP1
SCHEMBL25703812 0.75 ERCC5 (0.47) ERCC5FEN1ALDH1A1PPARGRXFP1
SCHEMBL24586272 0.75 AHR (0.39) ERCC5FEN1ALDH1A1KDM4EMEN1
SCHEMBL13183717 0.74 CYP1A2 (0.49) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL17454816 0.74 CYP1A2 (0.43) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL22180535 0.71 FEN1 (0.43) FEN1KDM4EHPGDHTTCSF1R
SCHEMBL454277 0.71 HTR2A (0.43) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL18494517 0.70 KIF11 (0.40) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL29091850 0.69 AHR (0.34) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL29986900 0.69 KIF11 (0.50) ERCC5FEN1ALDH1A1PPARGRXFP1

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
EP-4074706-A1 DEUTERATED HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DEVICE LG Display Co., Ltd. (KR) 2022-10-19 — — EP disclosed
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