SCHEMBL8992573

SCHEMBL8992573

Oc1ccc(-c2ccccc2)cc1Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
HPGD P15428 2/20 0.62
ALOX15 P16050 2/20 0.62
KMT2A Q03164 2/20 0.62
HSD17B10 Q99714 2/20 0.62
CYP3A4 P08684 1/20 0.62
HIF1A Q16665 1/20 0.62
BCL2 P10415 1/20 0.59
BCL2L1 Q07817 1/20 0.59
BACE1 P56817 1/20 0.57
CYP1A2 P05177 1/20 0.56
ALOX5 P09917 2/20 0.55
PTPN1 P18031 1/20 0.54
ACMSD Q8TDX5 2/20 0.53
IDH1 O75874 1/20 0.50
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HSP90AA1 P07900 1/20 0.50

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
SCHEMBL29738649 1.00 MEN1 (0.62) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL10558399 0.96 MEN1 (0.67) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL50409 0.90 BACE1 (0.62) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL29131806 0.83 ESR2 (0.58) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL8666716 0.83 BACE1 (0.56) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL17667205 0.82 BCL2L1 (0.52) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL8426147 0.81 MEN1 (0.54) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL17667206 0.81 BCL2L1 (0.50) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL6058626 0.81 MEN1 (0.50) MEN1HPGDALOX15KMT2AHSD17B10
SCHEMBL10886054 0.80 IDH1 (0.70) MEN1HPGDALOX15KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517043-B1 Aqueous coating and its use BAYER AG (DE) 1996-07-31 EP disclosed
US-5304400-A Process for coating heat resistant substrates with two component stoving compositions BAYER AKTIENGESELLSCHAFT (DE) 1994-04-19 US disclosed
EP-0335197-B1 POLYISOCYANATE POLYADDITION COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE DISPERSION OF SOLIDS BAYER AG (DE) 1992-08-12 EP disclosed
EP-0335197-A1 Polyisocyanate polyaddition compounds, process for their preparation and their use in the dispersion of solids BAYER AG (DE) 1989-10-04 EP disclosed
US-4770804-A HYDRAULIC AND METAL-WORKING FLUIDS BAYER AKTIENGESELLSCHAFT (DE) 1988-09-13 US disclosed
EP-0104377-B1 PROCESS FOR THE PREPARATION OF COATING COMPOSITIONS, AQUEOUS DISPERSIONS FOR REACTIVE POLYURETHANE SYSTEMS AND THEIR USE IN COATINGS BAYER AG (DE) 1985-11-13 EP disclosed
US-4507413-A Process for the preparation of coating compositions, aqueous dispersions of PU reactive systems and their use for coating BAYER AKTIENGESELLSCHAFT (DE) 1985-03-26 US disclosed
EP-0104377-A1 Process for the preparation of coating compositions, aqueous dispersions for reactive polyurethane systems and their use in coatings BAYER AG (DE) 1984-04-04 EP disclosed
EP-0015452-B1 6-SUBSTITUTED-3-DIMETHYLAMINO-4-METHYL-1,2,4-TRIAZIN-5-(4H)-ONES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AG (DE) 1982-01-20 EP disclosed
US-4120518-A DONOR LAYER CONTAINS A DYESTUFF PRECURSOR IN AN ORGANIC SOLVENT AS CORE MATERIAL AND POLYCARBODIIMIDE AS SHELL MATERIAL BAYER AKTIENGESELLSCHAFT (DE) 1978-10-17 US disclosed
US-4101273-A Disperse dyeing with polyglycerine anionic emulsifiers and/or polyaryl polyglycol ethers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-07-18 US disclosed
US-4049378-A Dyestuff preparations BAYER AKTIENGESELLSCHAFT (DT) 1977-09-20 US disclosed
US-4007172-A STYRYL DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-02-08 US disclosed