SCHEMBL30528007

SCHEMBL30528007

OC1(Cc2ccco2)C=CC=CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.35
ALDH1A1 P00352 5/20 0.34
TDP1 Q9NUW8 2/20 0.34
KMT2A Q03164 4/20 0.34
MAPT P10636 3/20 0.34
POLB P06746 2/20 0.34
CYP2C19 P33261 1/20 0.34
LMNA P02545 2/20 0.33
ALOX5 P09917 1/20 0.33
TSHR P16473 2/20 0.33
MEN1 O00255 2/20 0.33
PSMD14 O00487 1/20 0.33
MMP2 P08253 1/20 0.33
DNMT1 P26358 1/20 0.33
APEX1 P27695 1/20 0.33
PTPN7 P35236 1/20 0.33
RECQL P46063 1/20 0.33
HBB P68871 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL23631449 0.69
SCHEMBL28478768 0.68
SCHEMBL4085180 0.67 GBA1 (0.38) ALDH1A1LMNA
SCHEMBL9585009 0.67 TAAR1 (0.34) POLB
SCHEMBL27705308 0.66
SCHEMBL31604179 0.66 ALDH1A1 (0.36) EPHX2ALDH1A1TDP1KMT2AMAPT
SCHEMBL28681014 0.66 ALDH1A1 (0.41) ALDH1A1TDP1KMT2AMAPTPOLB
SCHEMBL27583423 0.66 KDM1A (0.39) ALDH1A1TDP1HSD17B10L3MBTL1GAA
SCHEMBL7799508 0.65
SCHEMBL2948109 0.65

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-118844594-A Sweetener and flavor compositions, methods of making and methods of using the same 伊比西(北京)植物药物技术有限公司 2024-10-29 CN disclosed
CN-112218542-B Sweetener and flavor compositions, methods of making and methods of using the same 伊比西(北京)植物药物技术有限公司 2023-08-25 CN disclosed