SCHEMBL9815879

SCHEMBL9815879

C=CCOC(=O)c1ccc2cc(C(=O)OC(O)C=C)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.44
CYP3A4 P08684 2/20 0.43
ADRB2 P07550 3/20 0.39
ADRB1 P08588 3/20 0.39
ADRB3 P13945 3/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TSHR P16473 1/20 0.38
PTPN1 P18031 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
KDM4E B2RXH2 2/20 0.37
HSP90AA1 P07900 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
RHOA P61586 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL429872 0.87 CYP3A4 (0.55) SNCACYP3A4ADRB2ADRB1ADRB3
SCHEMBL30107706 0.87 CYP3A4 (0.55) SNCACYP3A4ADRB2ADRB1ADRB3
SCHEMBL17386426 0.82 CYP3A4 (0.53) SNCACYP3A4ADRB2ADRB1ADRB3
SCHEMBL4430256 0.81 CYP3A4 (0.57) SNCACYP3A4ADRB2ADRB1ADRB3
SCHEMBL5135053 0.81 SNCA (0.49) SNCACYP3A4ALDH1A1HSD17B10TSHR
SCHEMBL18593579 0.80 CA12 (0.53) SNCACYP3A4ALDH1A1SMN1; SMN2NPC1
SCHEMBL9278105 0.80 SNCA (0.48) SNCACYP3A4ADRB2ADRB1ADRB3
SCHEMBL4907430 0.80 SNCA (0.48) SNCACYP3A4ALDH1A1HSD17B10TSHR
Hydrochloric Acid SCHEMBL9278114 0.80 SNCA (0.48) SNCACYP3A4ALDH1A1HSD17B10TSHR
SCHEMBL11046516 0.80 PTPN11 (0.54) SNCACYP3A4ADRB2ADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442887-A1 RECOVERY OF DIALKYL NAPHTHALENE-2,6-DICARBOXYLATES FROM NAPHTHALENE-2,6-DICARBOXYLIC ACID-CONTAINING POLYESTERS EASTMAN KODAK COMPANY (US) 1991-08-28 EP claimed
WO-1989011471-A1 RECOVERY OF DIALKYL NAPHTHALENE-2,6-DICARBOXYLATES FROM NAPHTHALENE-2,6-DICARBOXYLIC ACID-CONTAINING POLYESTERS EASTMAN KODAK COMPANY (US) 1989-11-30 WO claimed
US-4876378-A Recovery of dialkyl naphthalene-2,6-dicarboxylates from naphthalene-2,6-dicarboxylic acid-containing polyesters EASTMAN KODAK COMPANY (US) 1989-10-24 US claimed
EP-0442887-A1 RECOVERY OF DIALKYL NAPHTHALENE-2,6-DICARBOXYLATES FROM NAPHTHALENE-2,6-DICARBOXYLIC ACID-CONTAINING POLYESTERS EASTMAN KODAK COMPANY (US) 1991-08-28 EP disclosed
EP-0442887-A1 RECOVERY OF DIALKYL NAPHTHALENE-2,6-DICARBOXYLATES FROM NAPHTHALENE-2,6-DICARBOXYLIC ACID-CONTAINING POLYESTERS EASTMAN KODAK COMPANY (US) 1991-08-28 EP disclosed
WO-1989011471-A1 RECOVERY OF DIALKYL NAPHTHALENE-2,6-DICARBOXYLATES FROM NAPHTHALENE-2,6-DICARBOXYLIC ACID-CONTAINING POLYESTERS EASTMAN KODAK COMPANY (US) 1989-11-30 WO disclosed
WO-1989011471-A1 RECOVERY OF DIALKYL NAPHTHALENE-2,6-DICARBOXYLATES FROM NAPHTHALENE-2,6-DICARBOXYLIC ACID-CONTAINING POLYESTERS EASTMAN KODAK COMPANY (US) 1989-11-30 WO disclosed
US-4876378-A Recovery of dialkyl naphthalene-2,6-dicarboxylates from naphthalene-2,6-dicarboxylic acid-containing polyesters EASTMAN KODAK COMPANY (US) 1989-10-24 US disclosed
US-4876378-A Recovery of dialkyl naphthalene-2,6-dicarboxylates from naphthalene-2,6-dicarboxylic acid-containing polyesters EASTMAN KODAK COMPANY (US) 1989-10-24 US disclosed