SCHEMBL28870795

SCHEMBL28870795

COc1cccc(O)c1C=CC=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.53
BACE1 P56817 4/20 0.50
MAPT P10636 3/20 0.50
TP53 P04637 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
HSD17B10 Q99714 1/20 0.50
APP P05067 1/20 0.50
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
TSHR P16473 1/20 0.47
ABCG2 Q9UNQ0 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL28870792 1.00 XDH (0.53) XDHBACE1MAPTTP53KDM4E
SCHEMBL544419 0.87 ABCG2 (0.53) XDHKDM4EMAPK1ALDH1A1LMNA
SCHEMBL544418 0.87 ABCG2 (0.53) XDHKDM4EMAPK1ALDH1A1LMNA
SCHEMBL743608 0.82 ALDH1A1 (0.57) BACE1MAPTTP53KDM4EMAPK1
SCHEMBL9159172 0.81 CDK4 (0.59) XDHMAPTKDM4EMAPK1ALDH1A1
SCHEMBL9929133 0.80 MAPT (0.55) BACE1MAPTTP53KDM4EMAPK1
SCHEMBL31501089 0.78 BACE1 (0.59) BACE1MAPTTP53KDM4EMAPK1
SCHEMBL28431502 0.77 CDK4 (0.50) XDHMAPTKDM4EMAPK1ALDH1A1
SCHEMBL28431503 0.77 CDK4 (0.50) XDHMAPTKDM4EMAPK1ALDH1A1
SCHEMBL25192185 0.76 MAPT (0.45) MAPTALDH1A1LMNACYP3A4ATM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110092769-B Chromene derivative and synthesis method and application thereof 华东师范大学 2022-09-20 CN claimed
CN-110092769-B Chromene derivative and synthesis method and application thereof 华东师范大学 2022-09-20 CN disclosed