SCHEMBL28464159

SCHEMBL28464159

O=C1OCCc2ccc(cc2)OC(=O)c2ccc1cc2

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 4/20 0.36
NR1H3 Q13133 4/20 0.36
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL28856164 0.88 ALDH1A1 (0.39) ALDH1A1LMNATP53TSHRKMT2A
SCHEMBL18838920 0.80 ITGB2 (0.35) NR1H2NR1H3ALDH1A1LMNAKMT2A
SCHEMBL30894082 0.79 CA1 (0.43) ALDH1A1KMT2AHSP90AA1HSP90AB1
SCHEMBL2066276 0.77 ALOX15 (0.36) ALDH1A1KMT2A
SCHEMBL18695017 0.75 CA1 (0.33) ALDH1A1
SCHEMBL29759497 0.73 ALOX15 (0.36) NR1H2NR1H3ALDH1A1TSHR
SCHEMBL3874923 0.72 ITGB2 (0.43) ALDH1A1LMNATP53TSHRKMT2A
SCHEMBL22419 0.72 ITGB2 (0.43) ALDH1A1LMNATP53TSHRKMT2A
SCHEMBL17628649 0.72 ITGB2 (0.43) ALDH1A1LMNATP53TSHRKMT2A
SCHEMBL4534502 0.71 GLS (0.42) NR1H2NR1H3

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-111465660-B Use of multifunctional ligands for improving performance and stability of quantum dot inks 纳米系统公司 2022-11-04 CN disclosed
CN-113924022-A Cosmetic material-retaining carrier and cosmetic 株式会社黛怡茜 2022-01-11 CN disclosed
CN-108025143-B Convertible plunger and method for assembling same in a medical barrel SIO2医药产品公司 2021-08-24 CN disclosed
CN-111744102-A Drug particle delivery systems and methods 华沙整形外科股份有限公司 2020-10-09 CN disclosed