SCHEMBL31413664

SCHEMBL31413664

CC(=O)c1cc(-c2ccccc2)ccc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
MAPT P10636 2/20 0.53
ACMSD Q8TDX5 3/20 0.52
HNF4A P41235 2/20 0.52
DHFR P00374 1/20 0.52
MCL1 Q07820 1/20 0.52
HSD11B1 P28845 1/20 0.50
BRD4 O60885 1/20 0.49
EGFR P00533 1/20 0.49
PTPN1 P18031 2/20 0.49
IKBKB O14920 1/20 0.49
GSTA1 P08263 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
BCAT2 O15382 1/20 0.46
HDAC1 Q13547 2/20 0.45
FOLH1 Q04609 1/20 0.45
KDM4E B2RXH2 1/20 0.45
APOBEC3A P31941 1/20 0.45
GFER P55789 1/20 0.45

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
SCHEMBL5951431 1.00 SMN1; SMN2 (0.53) SMN1; SMN2MAPTACMSDHNF4ADHFR
SCHEMBL11435938 0.85 MAPT (0.53) SMN1; SMN2MAPTACMSDHNF4ADHFR
SCHEMBL27509903 0.84 ALDH1A1 (0.55) SMN1; SMN2ACMSDHNF4ADHFRMCL1
SCHEMBL1515723 0.84 BCAT2 (0.59) SMN1; SMN2MAPTHNF4AMEN1KMT2A
SCHEMBL593979 0.84 ACMSD (0.66) SMN1; SMN2ACMSDHNF4ADHFRMCL1
SCHEMBL17277091 0.83 MAP2 (0.48) SMN1; SMN2EGFRMEN1KMT2ABCAT2
SCHEMBL9271820 0.83 HDAC7 (0.58) SMN1; SMN2MEN1KMT2ABCAT2FOLH1
SCHEMBL3852134 0.82 BCAT2 (0.55) SMN1; SMN2MAPTHNF4AMEN1KMT2A
SCHEMBL31734825 0.82 BCAT2 (0.55) SMN1; SMN2MAPTHNF4AMEN1KMT2A
SCHEMBL3784987 0.81 BCAT2 (0.47) SMN1; SMN2MAPTMCL1BRD4MEN1

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-119504516-A Preparation method of composite fluorescent whitening agent 宁夏保隆科技有限公司 2025-02-25 CN claimed
CN-119504516-A Preparation method of composite fluorescent whitening agent 宁夏保隆科技有限公司 2025-02-25 CN disclosed