SCHEMBL2311085

SCHEMBL2311085

OCCc1cc2c3ccccc3cc(CCO)c2c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.40
DHODH Q02127 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HIF1A Q16665 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP1A2 P05177 2/20 0.38
HPGD P15428 2/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
AHR P35869 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TRPM4 Q8TD43 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
CYP1B1 Q16678 1/20 0.36
GPR84 Q9NQS5 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
SCHEMBL2312809 0.88 CYP1A2 (0.44) CHEK1DHODHALDH1A1HIF1AHSD17B10
SCHEMBL2311037 0.87 TRPM4 (0.48) CHEK1DHODHALDH1A1HIF1AHSD17B10
SCHEMBL2314306 0.86 CYP1A2 (0.46) ALDH1A1HIF1AHSD17B10CYP1A2HPGD
SCHEMBL2313216 0.84 CYP1A2 (0.43) DHODHALDH1A1HIF1AHSD17B10CYP1A2
SCHEMBL2313542 0.83 HSP90AA1 (0.40) CHEK1DHODHALDH1A1HIF1AHSD17B10
SCHEMBL2313421 0.81 CYP1A2 (0.41) ALDH1A1HIF1AHSD17B10CYP1A2HPGD
SCHEMBL2310208 0.81 TDP1 (0.41) CHEK1DHODHALDH1A1HIF1AHSD17B10
SCHEMBL2313863 0.81 TDP1 (0.41) CHEK1DHODHALDH1A1HIF1AHSD17B10
SCHEMBL2307245 0.80 ALDH1A1 (0.45) DHODHALDH1A1HIF1AHSD17B10CYP1A2
SCHEMBL2310404 0.80 ALDH1A1 (0.56) ALDH1A1HIF1AHSD17B10CYP1A2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed