SCHEMBL6561365

SCHEMBL6561365

C=Cc1cc(O)ccc1C#N

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 8/20 0.39
ESR1 P03372 7/20 0.39
ESRRB O95718 2/20 0.39
ESRRA P11474 2/20 0.39
AR P10275 3/20 0.39
EGFR P00533 4/20 0.38
CA9 Q16790 2/20 0.38
MIF P14174 1/20 0.38
CA12 O43570 1/20 0.37
CA2 P00918 1/20 0.37
CA3 P07451 1/20 0.37
CA6 P23280 1/20 0.37
CA14 Q9ULX7 1/20 0.37
LCK P06239 1/20 0.37
AURKA O14965 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
TYR P14679 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
SCHEMBL5332124 0.84 ESR2 (0.42) ESR2ESR1ESRRBESRRAAR
SCHEMBL28229690 0.80 EGFR (0.41) ESR2ESR1ESRRBESRRAAR
SCHEMBL16960777 0.78 IMPDH2 (0.37) ARCA9CA12CA2CA3
SCHEMBL23465259 0.76 KDM4E (0.47) AR
SCHEMBL3748043 0.76 TRPV4 (0.38) AR
SCHEMBL16961223 0.76 MAOB (0.42) AR
SCHEMBL16956740 0.76 VCAM1 (0.44) AR
SCHEMBL13964708 0.76 AR (0.39) AR
SCHEMBL23405836 0.75 TRPV4 (0.30) AR
SCHEMBL6010545 0.74 MIF (0.56) ESR2ESR1EGFRCA9MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0996870-B1 IMPROVED DISSOLUTION INHIBITION RESISTS FOR MICROLITHOGRAPHY DU PONT (US) 2004-03-24 EP disclosed
US-6319648-B1 USED FOR IMAGING MATERIALS OF SEMICONDUCTOR DEVICE E. I. DU PONT DE NEMOURS AND COMPANY 2001-11-20 US disclosed
EP-0996870-A1 IMPROVED DISSOLUTION INHIBITION RESISTS FOR MICROLITHOGRAPHY E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-03 EP disclosed
WO-1999004319-A1 IMPROVED DISSOLUTION INHIBITION RESISTS FOR MICROLITHOGRAPHY E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-01-28 WO disclosed