SCHEMBL625698

SCHEMBL625698

CC(=Cc1ccc2ccccc2c1)C(=O)O.O=C(O)C=Cc1ccc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.53
AKR1C3 P42330 1/20 0.51
PTPN1 P18031 1/20 0.51
CYP3A4 P08684 1/20 0.48
RELA Q04206 1/20 0.47
RAB9A P51151 2/20 0.47
DHODH Q02127 1/20 0.46
HDAC3 O15379 1/20 0.46
TNKS O95271 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HCAR2 Q8TDS4 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46

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
SCHEMBL29966982 0.89 AKR1C3 (0.63) AKR1C3PTPN1RELADHODH
SCHEMBL51774 0.89 AKR1C3 (0.63) AKR1C3PTPN1RELADHODH
SCHEMBL122093 0.89 AKR1C3 (0.63) AKR1C3PTPN1RELADHODH
Hydrochloric Acid SCHEMBL6780341 0.88 AKR1C3 (0.61) AKR1C3PTPN1RELADHODH
Hydrochloric Acid SCHEMBL27571578 0.88 AKR1C3 (0.61) AKR1C3PTPN1RELADHODH
SCHEMBL78426 0.86 RELA (0.62) ESR1PTPN1CYP3A4RELARAB9A
SCHEMBL78427 0.86 RELA (0.62) ESR1PTPN1CYP3A4RELARAB9A
SCHEMBL6552210 0.86 RELA (0.62) ESR1PTPN1CYP3A4RELARAB9A
SCHEMBL29966677 0.86 RELA (0.62) ESR1PTPN1CYP3A4RELARAB9A
SCHEMBL29462468 0.86 RELA (0.62) ESR1PTPN1CYP3A4RELARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2380775-B1 OPTICALLY PERMEABLE, DEEP DRAWABLE ELECTRODE AND FLAT ELEMENT COMPRISING SAME FOR EL FILMS/LAMPS TESA SE (DE) 2016-11-23 EP disclosed
EP-1882707-B1 bimodal acrylate adhesive mass for gluing low energy and rough surfaces TESA SE (DE) 2016-05-18 EP disclosed
WO-2012020009-A1 LIGHTING MEANS WHICH CAN IN PARTICULAR BE THERMOFORMED TESA SE (DE) 2012-02-16 WO disclosed
EP-2380775-A1 Optically permeable, deep drawable electrode and flat element comprising same for EL films/lamps tesa SE (DE) 2011-10-26 EP disclosed
EP-2001969-B1 ELECTROLUMINESCENT ADHESIVE MASSES TESA SE (DE) 2011-08-03 EP disclosed
EP-2334516-A2 EMBOSSABLE LICENSE PLATE TESA SE (DE) 2011-06-22 EP disclosed
WO-2010037712-A2 EMBOSSABLE LICENSE PLATE TESA SE (DE) 2010-04-08 WO disclosed
WO-2010037673-A2 EMBOSSABLE LICENSE PLATE TESA SE (DE) 2010-04-08 WO disclosed
EP-2168816-A1 Embossable licence plate Sauer, Arno Martin (DE) 2010-03-31 EP disclosed
EP-2001969-A1 ELECTROLUMINESCENT ADHESIVE MASSES Tesa AG (DE) 2008-12-17 EP disclosed
EP-1882707-A1 bimodal acrylate adhesive mass for gluing low energy and rough surfaces Tesa AG (DE) 2008-01-30 EP disclosed
WO-2007107591-A1 ELECTROLUMINESCENT ADHESIVE MASSES TESA AG (DE) 2007-09-27 WO disclosed