SCHEMBL301408

SCHEMBL301408

C=CC(F)c1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
CYP1A2 P05177 3/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2A6 P11509 3/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ADRA2A P08913 4/20 0.37
ADRA2B P18089 4/20 0.37
ADRA2C P18825 4/20 0.37
ADRA1A P35348 4/20 0.37
ADRA1D P25100 3/20 0.37
ADRA1B P35368 3/20 0.37
SLC6A4 P31645 1/20 0.37
ACP3 P15309 1/20 0.36
AOC3 Q16853 1/20 0.36
HPGD P15428 2/20 0.35
CYP3A4 P08684 1/20 0.35
KEAP1 Q14145 1/20 0.35

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
SCHEMBL9258574 0.79 ALDH1A1 (0.54) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL8378944 0.77 ALDH1A1 (0.56) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL1538539 0.76 ALDH1A1 (0.60) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL31317937 0.76 ALDH1A1 (0.60) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL7924283 0.76 ALDH1A1 (0.61) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL1325659 0.76 CYP1A2 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL11600460 0.76 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL1683810 0.76 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL3408300 0.76 ALDH1A1 (0.55) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6
SCHEMBL1149420 0.76 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19CYP2A6

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-1627213-B1 ANTIFRICTION BEARING PROVIDED WITH POLYMER ELECTRONICS SCHAEFFLER TECHNOLOGIES AG (DE) 2012-03-14 EP claimed
US-7827871-B2 Antifriction bearing provided with polymer electronics SCHAEFFLER KG (DE) 2010-11-09 US claimed
US-7742281-B2 Solid electrolytic capacitor SANYO ELECTRIC CO., LTD. (JP) 2010-06-22 US claimed
US-20070277612-A1 Antifriction Bearing Provided With Polymer Electronics Schaeffler Technologies AG & Co. KG (DE) 2007-12-06 US claimed
US-7827871-B2 Antifriction bearing provided with polymer electronics SCHAEFFLER KG (DE) 2010-11-09 US disclosed
US-7742281-B2 Solid electrolytic capacitor SANYO ELECTRIC CO., LTD. (JP) 2010-06-22 US disclosed
US-20080158783-A1 SOLID ELECTROLYTIC CAPACITOR SANYO ELECTRIC CO., LTD. (JP) 2008-07-03 US disclosed
US-20070277612-A1 Antifriction Bearing Provided With Polymer Electronics Schaeffler Technologies AG & Co. KG (DE) 2007-12-06 US disclosed