SCHEMBL6850756

SCHEMBL6850756

CCCCCCCCC(CCC)c1cc[c]cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.44
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
SLC2A1 P11166 1/20 0.35
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CSNK1E P49674 1/20 0.32
DNM1 Q05193 2/20 0.31
CYSLTR2 Q9NS75 1/20 0.31
CYSLTR1 Q9Y271 1/20 0.31
OPRM1 P35372 1/20 0.30

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
SCHEMBL5480284 1.00 NR1I2 (0.44) NR1I2ESR1ESR2SLC2A1LMNA
SCHEMBL8859009 0.98 NR1I2 (0.41) NR1I2ESR1ESR2SLC2A1OPRM1
SCHEMBL982650 0.96 NR1I2 (0.46) NR1I2SLC2A1LMNAALDH1A1CSNK1E
SCHEMBL10357844 0.96 NR1I2 (0.46) NR1I2SLC2A1LMNAALDH1A1CSNK1E
SCHEMBL10358358 0.94 NR1I2 (0.45) NR1I2SLC2A1LMNAALDH1A1CSNK1E
SCHEMBL983798 0.94 NR1I2 (0.44) NR1I2ESR1ESR2SLC2A1LMNA
SCHEMBL10358926 0.92 NR1I2 (0.42) NR1I2ESR1ESR2SLC2A1LMNA
SCHEMBL28031202 0.92 ESR1 (0.38) NR1I2ESR1ESR2
SCHEMBL6162603 0.89 NR1I2 (0.55) NR1I2ESR1ESR2SLC2A1LMNA
SCHEMBL28140502 0.89 NR1I2 (0.55) NR1I2ESR1ESR2SLC2A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1413593-A1 CATALYST FOR POLYESTER PRODUCTION AND PROCESS FOR PRODUCING POLYESTER WITH THE SAME TEIJIN LIMITED (JP) 2004-04-28 EP claimed
US-20200087570-A1 SURFACTANT COMPOSITION AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI RESEARCH INSTITUTE OF PETROCHEMICAL TECHNOLOGY, SINOPEC (CN) 2020-03-19 US disclosed
CN-103814330-B Negative working lithographic prints plate front body 伊斯曼柯达公司 2017-08-11 CN disclosed
CN-103917919-B Lithographic printing plate precursors for on-press development 伊斯曼柯达公司 2017-07-14 CN disclosed
CN-101454722-B Negative-working radiation-sensitive compositions and imageable materials EASTMAN KODAK CO 2012-07-04 CN disclosed
EP-0209990-B1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-12-19 EP disclosed
US-4725284-A Thermal transfer printing with z-alkyl-phenoxy anthraquinone dye mixture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-02-16 US disclosed
EP-0209990-A2 Thermal transfer printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-01-28 EP disclosed