SCHEMBL7604074

SCHEMBL7604074

OCc1ccc2ccccc2c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.46
HPGDS O60760 1/20 0.45
TDP1 Q9NUW8 3/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP2A6 P11509 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GABRA1 P14867 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
HPGD P15428 1/20 0.40
MPI P34949 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
HPRT1 P00492 1/20 0.39

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
SCHEMBL8050013 0.87 HSD17B10 (0.50) WDR5TDP1ALDH1A1CYP2A6TSHR
SCHEMBL30367845 0.87 HSD17B10 (0.50) WDR5TDP1ALDH1A1CYP2A6TSHR
SCHEMBL1930918 0.83 PDCD1 (0.48) ALDH1A1CYP2A6TSHRHSD17B10KMT2A
SCHEMBL6681906 0.82 HPGDS (0.45) WDR5HPGDSTDP1ALDH1A1CYP2A6
SCHEMBL7600324 0.82 WDR5 (0.44) WDR5TDP1ALDH1A1CYP2A6TSHR
SCHEMBL7931301 0.82 TDP1 (0.41) WDR5TDP1ALDH1A1CYP2A6TSHR
SCHEMBL16624708 0.82 TDP1 (0.61) WDR5TDP1ALDH1A1TSHRHSD17B10
SCHEMBL17360625 0.81 GPR55 (0.46) GABRA1GABRG2GABRB3
Phosphine SCHEMBL28241094 0.81 WDR5 (0.43) WDR5TDP1ALDH1A1CYP2A6TSHR
Phosphine SCHEMBL28241012 0.81 HPGDS (0.44) WDR5HPGDSTDP1ALDH1A1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2941472-A1 MATERIALS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2015-11-11 EP disclosed
EP-2892876-A1 CONNECTIONS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2015-07-15 EP disclosed
WO-2014106522-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2014-07-10 WO disclosed
WO-2014037077-A1 CONNECTIONS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2014-03-13 WO disclosed
EP-0672675-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2002-07-24 EP disclosed
EP-1123938-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 2001-08-16 EP disclosed
CN-1049438-C Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2000-02-16 CN disclosed
US-5604242-A ALKOXY- AND CARBOXY-SUBSTITUTED PIPERIDINES FOR SUPPRESSING UPTAKE OF GAMMA-AMINOBUTYRIC ACID, ANALGESICS, ANXIOLYTIC OR ANTIEPILEPTIC AGENTS NOVO NORDISK A/S (DK) 1997-02-18 US disclosed
EP-0705248-A1 N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND ESTERS THEREOF NOVO NORDISK A/S (DK) 1996-04-10 EP disclosed
CN-1117975-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 1996-03-06 CN disclosed
EP-0672675-A1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-09-20 EP disclosed
US-5451649-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-09-19 US disclosed
WO-1995000486-A1 N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND ESTERS THEREOF NOVO NORDISK A/S (DK) 1995-01-05 WO disclosed
US-4276305-A INSECTICIDES, MITICIDES HOFFMANN-LA ROCHE INC. (US) 1981-06-30 US disclosed