SCHEMBL11825825

SCHEMBL11825825

CCCOC(=O)C(=Cc1ccccc1O)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.41
▸ GAA P10253 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ALOX5 P09917 4/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ PTGES O14684 2/20 0.38
▸ POLB P06746 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ CNR2 P34972 1/20 0.35

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
SCHEMBL29211156 0.80 ALOX5 (0.48) LMNAGAASMN1; SMN2CYP3A4CYP2C9
SCHEMBL28385950 0.79 ALDH1A1 (0.44) LMNAGAASMN1; SMN2ALDH1A1POLB
SCHEMBL27942078 0.77 MAPT (0.59) LMNAGAASMN1; SMN2CYP3A4CYP2C9
SCHEMBL28560019 0.77 LMNA (0.43) LMNAGAASMN1; SMN2ALDH1A1POLB
SCHEMBL27904667 0.76 MAPT (0.41) LMNAGAASMN1; SMN2CYP2C9ALDH1A1
SCHEMBL21457184 0.75 MIF (0.59) SMN1; SMN2CYP2C9ALDH1A1POLBL3MBTL1
SCHEMBL21457187 0.75 MIF (0.59) SMN1; SMN2CYP2C9ALDH1A1POLBL3MBTL1
SCHEMBL1119168 0.74 CES2 (0.55) LMNAGAASMN1; SMN2CYP3A4ALDH1A1
SCHEMBL3129239 0.73 ALOX5 (0.52) LMNASMN1; SMN2CYP3A4CYP2C9ALOX5
SCHEMBL3129250 0.73 ALOX5 (0.52) LMNASMN1; SMN2CYP3A4CYP2C9ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3998851-A PREPARATION OF COUMARINS UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-12-21 — — US disclosed
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