SCHEMBL24650792

SCHEMBL24650792

CCOC(=O)C1c2cc(OCC)ccc2CC1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 2/20 0.39
BRD4 O60885 1/20 0.39
PKM P14618 1/20 0.39
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
GAA P10253 3/20 0.38
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PPARD Q03181 1/20 0.37
PARP10 Q53GL7 1/20 0.37
ABL1 P00519 1/20 0.37
LMNA P02545 1/20 0.36
ACHE P22303 1/20 0.36
POLB P06746 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
SCHEMBL24650797 0.90 CHRNB2 (0.43) NQO2MTNR1AMTNR1BTSHRKMT2A
SCHEMBL24650763 0.90 ALDH1A1 (0.43) NQO2MTNR1AMTNR1BTSHRKMT2A
SCHEMBL24650845 0.90 NQO2 (0.44) NQO2MTNR1AMTNR1BKMT2AALDH1A1
SCHEMBL24650760 0.84 OPRM1 (0.40) NQO2MTNR1AMTNR1BTSHRKMT2A
SCHEMBL24650264 0.81 BRD4 (0.43) NQO2MTNR1AMTNR1BKMT2ABRD4
SCHEMBL24650883 0.80 NQO2 (0.40) NQO2MTNR1AMTNR1BKMT2ABRD4
SCHEMBL24650855 0.80 MAPT (0.41) TSHRKMT2AALDH1A1KDM4EMEN1
SCHEMBL24650775 0.80 ALOX15 (0.45) TSHRKMT2AALDH1A1KDM4EGAA
SCHEMBL24650831 0.80 CHRNB2 (0.43) NQO2MTNR1AMTNR1BKMT2AALDH1A1
SCHEMBL6395808 0.78 NQO2 (0.41) NQO2MTNR1AMTNR1BTSHRKMT2A

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-2022238507-A1 THERAPEUTIC AMINOINDANE COMPOUNDS AND COMPOSITIONS AWAKN LS EUROPE HOLDINGS LIMITED (IE) 2022-11-17 WO disclosed