SCHEMBL24969677

SCHEMBL24969677

CC(C)(C)c1ccc2c(c1)-c1c(Nc3cccc(-c4ccccc4)c3)cc(-c3ccccc3)cc1C2(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.37
▸ KCNK18 Q7Z418 1/20 0.37
▸ ABCG2 Q9UNQ0 3/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ CNR1 P21554 2/20 0.34
▸ STK10 O94804 1/20 0.33
▸ SLK Q9H2G2 1/20 0.33
▸ HSD17B2 P37059 1/20 0.33
▸ AKR1C3 P42330 1/20 0.32
▸ KIF11 P52732 3/20 0.32
▸ RXRA P19793 1/20 0.32
▸ RXRB P28702 1/20 0.32
▸ FABP1 P07148 1/20 0.31
▸ ABCB1 P08183 2/20 0.31
▸ ABCC1 P33527 1/20 0.31
▸ KCNK9 Q9NPC2 1/20 0.31

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
SCHEMBL24969676 0.86 FABP3 (0.35) KCNK18HSD17B2
SCHEMBL25124669 0.84 HSD17B2 (0.33) KCNK18HSD17B2
SCHEMBL26922642 0.76 CNR1 (0.44) SYKKCNK18ABCG2SIRT2SIRT1
SCHEMBL30671757 0.76 CNR1 (0.44) SYKKCNK18ABCG2SIRT2SIRT1
SCHEMBL24401357 0.76 ALDH1A1 (0.38) KCNK18ABCG2STK10SLKAKR1C3
SCHEMBL30363478 0.76 KCNK18 (0.37) KCNK18ABCG2STK10SLKAKR1C3
SCHEMBL23927586 0.75 KCNK18 (0.36) KCNK18ABCG2AKR1C3KIF11
SCHEMBL25125106 0.75 KCNK18 (0.38) KCNK18ABCG2STK10SLK
SCHEMBL15250346 0.74 SIRT2 (0.45) SYKSIRT2SIRT1STK10SLK
SCHEMBL21368167 0.74 PDK2 (0.39) —

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-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 — — WO disclosed
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