SCHEMBL25567734

SCHEMBL25567734

Clc1ccc2c(c1)sc1c(-c3cccc(-c4ccc5ccccc5c4)c3)cccc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.47
CYP1A1 P04798 4/20 0.41
CYP1B1 Q16678 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2A6 P11509 1/20 0.39
LIMK1 P53667 1/20 0.39
CNR1 P21554 1/20 0.38
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
S1PR5 Q9H228 7/20 0.37
S1PR4 O95977 6/20 0.37
PRKDC P78527 1/20 0.36
GSTP1 P09211 1/20 0.36
HDAC4 P56524 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34

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
SCHEMBL18086204 0.87 ALOX5 (0.61) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL25118599 0.85 ALOX5 (0.59) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL21795025 0.85 ALOX5 (0.59) ALOX5CYP1A1CYP1B1CYP1A2CYP2A6
SCHEMBL12023548 0.84 ALOX5 (0.58) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL21180371 0.84 ALOX5 (0.49) ALOX5CYP1A1CYP1B1CYP1A2CYP2A6
SCHEMBL17167404 0.84 ALOX5 (0.64) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL12023545 0.83 ALOX5 (0.57) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL15857005 0.83 ALOX5 (0.59) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL25118600 0.83 ALOX5 (0.56) ALOX5HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL15893284 0.83 ALOX5 (0.51) ALOX5HSD17B1HSD17B2S1PR5S1PR4

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
WO-2023096209-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-06-01 WO disclosed