SCHEMBL9730500

SCHEMBL9730500

c1ccc(Oc2ccc(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
ADORA2A P29274 1/20 0.44
LTA4H P09960 2/20 0.42
TSHR P16473 1/20 0.42
GSTP1 P09211 1/20 0.41
TTR P02766 2/20 0.41
PTGS2 P35354 1/20 0.40
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP3A4 P08684 1/20 0.38
KMT2A Q03164 3/20 0.37
LMNA P02545 2/20 0.37
GAA P10253 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL10838290 0.94 GSTP1 (0.50) NCOA1NCOA3ADORA2ALTA4HTSHR
SCHEMBL1203982 0.90 NCOA1 (0.37) NCOA1NCOA3ADORA2AGSTP1LMNA
SCHEMBL10746370 0.86 NCOA1 (0.49) NCOA1NCOA3ADORA2ALTA4HTSHR
SCHEMBL31613230 0.85 NCOA1 (0.61) NCOA1NCOA3ADORA2ATSHRGSTP1
SCHEMBL454644 0.85 NCOA1 (0.43) NCOA1NCOA3ADORA2ALTA4HTSHR
SCHEMBL9217027 0.85 NCOA1 (0.43) NCOA1NCOA3ADORA2ALTA4HTSHR
SCHEMBL497256 0.84 NCOA1 (0.55) NCOA1NCOA3ADORA2ALTA4HTSHR
SCHEMBL25873116 0.81 GSTP1 (0.55) NCOA1NCOA3LTA4HTSHRGSTP1
SCHEMBL27757744 0.80 ALDH1A1 (0.52) LTA4HTSHRTTRKMT2AMAPT
SCHEMBL6823361 0.79 NCOA1 (0.39) NCOA1NCOA3ADORA2ALTA4HTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116813454-A Synthetic method of pterostilbene 珠海市柏瑞医药科技有限公司 2023-09-29 CN claimed
CN-116813454-B Synthetic method of pterostilbene 珠海市柏瑞医药科技有限公司 2024-03-22 CN disclosed
CN-116813454-A Synthetic method of pterostilbene 珠海市柏瑞医药科技有限公司 2023-09-29 CN disclosed
US-5107031-A Proces to recover 4-phenoxybiphenyl THE DOW CHEMICAL COMPANY (US) 1992-04-21 US disclosed