SCHEMBL11049580

SCHEMBL11049580

CC(=O)Oc1ccc(Oc2cccc(OC(C)=O)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
CYP3A4 P08684 2/20 0.61
ACHE P22303 1/20 0.56
MTNR1B P49286 2/20 0.53
MTNR1A P48039 1/20 0.53
ELANE P08246 1/20 0.52
MAPT P10636 5/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 2/20 0.51
TTR P02766 1/20 0.51
TP53 P04637 1/20 0.51
GAA P10253 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 2/20 0.49
HSP90AA1 P07900 1/20 0.49
POLB P06746 1/20 0.48
PKM P14618 1/20 0.48
MITF O75030 1/20 0.48

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
SCHEMBL5040450 0.92 CYP3A4 (0.61) LMNACYP3A4ACHEMTNR1BMTNR1A
SCHEMBL11840503 0.90 LMNA (0.54) LMNACYP3A4ACHEMTNR1BMTNR1A
SCHEMBL2707543 0.88 SRD5A2 (0.62) LMNACYP3A4ELANEKDM4EGAA
SCHEMBL17028900 0.88 LMNA (0.76) LMNACYP3A4ACHEELANEMAPT
SCHEMBL249305 0.88 LMNA (0.76) LMNACYP3A4ACHEELANEMAPT
SCHEMBL26009141 0.87 MTNR1B (0.59) LMNACYP3A4ACHEMTNR1BMTNR1A
SCHEMBL8390971 0.86 AKR1C3 (0.53) MTNR1BMTNR1AMAPTMEN1KMT2A
SCHEMBL1821477 0.86 ELANE (0.68) LMNACYP3A4ELANEMAPTMEN1
SCHEMBL9760958 0.85 LMNA (0.70) LMNACYP3A4ACHEELANEMAPT
SCHEMBL5027571 0.85 LMNA (0.70) LMNACYP3A4ACHEELANEMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0026991-B1 AROMATIC POLYESTER AND FILAMENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-03-21 EP disclosed
US-4269965-A COMPRISING MONOMERS OF P-HYDROXYBENZOIC ACID, 3,4'-DIHYDROXYBENZOPHENONE OR TEREPHTHALOYLDI(3-METHYL-4-HYDROXYBENZENE, AND TEREPHTHALIC ACID; LUSTER E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-05-26 US disclosed
EP-0026991-A1 Aromatic polyester and filaments E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-04-15 EP disclosed