SCHEMBL27013058

SCHEMBL27013058

c1ccc2cc(-c3cccc4c3oc3cccc(-c5ccc6ccc7cccc8ccc5c6c78)c34)ccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.45
▸ PRKDC P78527 2/20 0.43
▸ CYP1A2 P05177 3/20 0.39
▸ ERBB2 P04626 1/20 0.39
▸ FYN P06241 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ AHR P35869 1/20 0.39
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ GSTP1 P09211 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ CASP1 P29466 2/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CASP7 P55210 1/20 0.36

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
SCHEMBL27013320 0.97 ALOX5 (0.45) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL27013317 0.96 ALOX5 (0.44) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL27013078 0.94 ALOX5 (0.42) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL26077999 0.94 ALOX5 (0.42) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL27013318 0.93 ALOX5 (0.40) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL9920860 0.88 ALOX5 (0.56) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL27013054 0.88 ALOX5 (0.40) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL12380340 0.88 ALOX5 (0.56) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL27013052 0.88 CDC14B (0.40) ALOX5PRKDCCYP1A2ERBB2FYN
SCHEMBL26078010 0.88 ALOX5 (0.41) ALOX5PRKDCCYP1A2ERBB2FYN

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
US-20240023359-A1 ORGANIC LIGHT-EMITTING DEVICE COMPRISING NOVEL ORGANIC COMPOUND IN EMISSION LAYER SFC CO., LTD. (KR) 2024-01-18 — — US disclosed
US-20240023359-A1 ORGANIC LIGHT-EMITTING DEVICE COMPRISING NOVEL ORGANIC COMPOUND IN EMISSION LAYER SFC CO., LTD. (KR) 2024-01-18 — — US disclosed
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