SCHEMBL25567679

SCHEMBL25567679

Clc1ccc2c(c1)sc1cc(-c3ccccc3-c3ccccc3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.41
BCKDK O14874 1/20 0.41
MCL1 Q07820 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
KDM4E B2RXH2 3/20 0.39
CYP2A6 P11509 1/20 0.38
LIMK1 P53667 2/20 0.38
F9 P00740 1/20 0.38
MAPK1 P28482 1/20 0.37
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
PTGS2 P35354 2/20 0.37
PTGS1 P23219 1/20 0.37
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
MAP4K4 O95819 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
SCHEMBL25567821 0.92 KDM4E (0.43) RXFP1BCKDKMCL1CYP1A2KMT2A
SCHEMBL24969655 0.88 CYP1A2 (0.50) RXFP1BCKDKMCL1CYP1A2KDM4E
SCHEMBL23024880 0.88 KDM4E (0.45) RXFP1BCKDKMCL1CYP1A2KMT2A
SCHEMBL21866684 0.84 GPR3 (0.52) CYP1A2LIMK1F9PTGS2ALDH1A1
SCHEMBL30477722 0.84 GPR3 (0.52) CYP1A2LIMK1F9PTGS2ALDH1A1
SCHEMBL25818409 0.84 ALDH1A1 (0.40) RXFP1BCKDKMCL1CYP1A2KDM4E
SCHEMBL25568103 0.81 F9 (0.40) RXFP1BCKDKMCL1CYP1A2KMT2A
SCHEMBL25568021 0.81 F9 (0.40) RXFP1BCKDKMCL1KMT2AMEN1
SCHEMBL22227748 0.81 HTT (0.46) RXFP1BCKDKMCL1CYP1A2KMT2A
SCHEMBL24777874 0.81 F9 (0.42) RXFP1BCKDKMCL1CYP1A2KMT2A

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