SCHEMBL12972960

SCHEMBL12972960

Cc1cc(C2CCCCC2)c(C)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ HPGD P15428 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PSMB5 P28074 2/20 0.37
▸ JAK2 O60674 2/20 0.34
▸ JAK1 P23458 2/20 0.34
▸ TYK2 P29597 2/20 0.34
▸ JAK3 P52333 2/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NR1I2 O75469 1/20 0.33
▸ KDM4B O94953 1/20 0.33

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
SCHEMBL13227390 0.84 ALDH1A1 (0.34) ALDH1A1HPGDSMN1; SMN2HSD17B10MEN1
SCHEMBL17996705 0.77 MAPT (0.41) ALDH1A1HPGDSMN1; SMN2HSD17B10MEN1
SCHEMBL20045293 0.75 ALDH1A1 (0.36) ALDH1A1HPGDSMN1; SMN2HSD17B10MEN1
SCHEMBL12607740 0.74 GPR35 (0.33) ALDH1A1HPGDSMN1; SMN2HSD17B10MEN1
SCHEMBL12607743 0.72 ALDH1A1 (0.32) ALDH1A1HPGDSMN1; SMN2HSD17B10MEN1
SCHEMBL9167795 0.70 PSMB5 (0.46) MEN1MAPTKMT2APSMB5JAK2
SCHEMBL22675025 0.69 ALDH1A1 (0.39) ALDH1A1HPGDSMN1; SMN2NR1I2KDM4B
SCHEMBL15243172 0.69 TDO2 (0.43) MEN1MAPTKMT2APSMB5JAK2
SCHEMBL10788453 0.69 PSMB5 (0.44) MEN1MAPTKMT2APSMB5JAK2
SCHEMBL22674968 0.68 ALDH1A1 (0.39) ALDH1A1HPGDSMN1; SMN2RXFP1

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
US-7851074-B2 Organic electroluminescent display device and chemical compounds for liquid crystals TOHOKU PIONEER CORPORATION (JP) 2010-12-14 — — US disclosed
US-7691493-B2 Polymeric compound and organic luminescence device CANON KABUSHIKI KAISHA (JP) 2010-04-06 — — US disclosed
US-20100068461-A1 NANOSTRUCTURED COMPOSITES UNIVERSITY OF WOLLONGONG (AU) 2010-03-18 — — US disclosed
US-20090230860-A1 POLYMER COMPOUND AND ELECTROLUMINESCENT ELEMENT CANON KABUSHIKI KAISHA (JP) 2009-09-17 — — US disclosed
US-7537884-B2 Method for forming self-synthesizing conductive or conjugated polymer film and application NATIONAL TAIWAN UNIVERSITY (TW) 2009-05-26 — — US disclosed
US-20090058277-A1 Organic Electroluminescent Display Device and Chemical Compounds for Liquid Crystals TOHOKU PIONEER CORPORATION (JP) 2009-03-05 — — US disclosed
US-20070257604-A1 POLYMERIC COMPOUND AND ORGANIC LUMINESCENCE DEVICE CANON KABUSHIKI KAISHA (JP) 2007-11-08 — — US disclosed
US-20070164257-A1 Organic electroluminescent display device and chemical compounds for liquid crystals TOHOKU PIONEER CORPORATION 2007-07-19 — — US disclosed
US-7238435-B2 Polymeric compound and organic luminescence device CANON KABUSHIKI KAISHA (JP) 2007-07-03 — — US disclosed
US-7195826-B2 Charge transfer compounds; containing organiridium compound TOHOKU PIONEER CORPORATION (JP) 2007-03-27 — — US disclosed
US-20070032632-A1 Electroluminescence polymer, organic el device, and display SONY CHEMICALS CORP. (JP) 2007-02-08 — — US disclosed
US-20070032632-A1 Electroluminescence polymer, organic el device, and display SONY CHEMICALS CORP. (JP) 2007-02-08 — — US disclosed
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