SCHEMBL24326985

SCHEMBL24326985

CCCCS(=O)(=O)N1CCc2cccc(C)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.40
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 3/20 0.37
CNR2 P34972 1/20 0.37
TSHR P16473 2/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 1/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
HTR6 P50406 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CRHBP P24387 1/20 0.35
HTT P42858 1/20 0.35
CRHR2 Q13324 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
HTR2C P28335 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
SCHEMBL24326991 0.92 ALOX12 (0.42) ALOX12MEN1KMT2AMAPTCNR2
SCHEMBL24326990 0.87 MAPT (0.46) ALOX12MEN1KMT2AMAPTCNR2
SCHEMBL26777795 0.83 FNTA (0.35) MEN1KMT2AMAPTTSHRPOLB
SCHEMBL24328583 0.81 ALOX12 (0.43) ALOX12MEN1KMT2AMAPTCNR2
SCHEMBL24327001 0.78 KMT2A (0.63) ALOX12MEN1KMT2AMAPTTSHR
SCHEMBL14591313 0.77 ALOX12 (0.47) ALOX12MEN1KMT2AMAPTCNR2
SCHEMBL24327005 0.77 ALOX12 (0.34) ALOX12MEN1KMT2AMAPTCNR2
SCHEMBL3665951 0.74 MEN1 (0.58) MEN1KMT2AMAPTTSHRPOLB
SCHEMBL26777798 0.74 L3MBTL1 (0.36) MEN1KMT2AMAPTTSHRPOLB
SCHEMBL24328578 0.74 ALOX12 (0.44) ALOX12MEN1KMT2AMAPTCNR2

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-2022063106-A1 INDOLINE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS BEIGENE, LTD. (KY) 2022-03-31 WO disclosed