SCHEMBL20052278

SCHEMBL20052278

CNc1cc(CC(C)(C)C)ccn1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 9/20 0.43
IGF1R P08069 1/20 0.36
ESR1 P03372 1/20 0.35
NUDT1 P36639 1/20 0.34
TYK2 P29597 1/20 0.34
NOS2 P35228 2/20 0.33
LOX P28300 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
FLT4 P35916 1/20 0.33
GPR39 O43194 1/20 0.33
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL23073868 0.86 NR3C2 (0.44) NR3C2IGF1RNOS2FLT4NOS3
SCHEMBL18270397 0.84 NR3C2 (0.40) NR3C2IGF1RTYK2NOS2FLT4
Hydrochloric Acid SCHEMBL28505566 0.82 IGF1R (0.40) NR3C2IGF1RTYK2LOXLOXL2
SCHEMBL31325755 0.79 NOS2 (0.53) NR3C2IGF1RTYK2NOS2FLT4
SCHEMBL2056325 0.79 NOS2 (0.53) NR3C2IGF1RTYK2NOS2FLT4
SCHEMBL18924315 0.78 IGF1R (0.42) NR3C2IGF1R
SCHEMBL2643260 0.77 NR3C2 (0.36) NR3C2IGF1RTYK2NOS2FLT4
SCHEMBL4306508 0.77 RECQL (0.52) NR3C2TYK2
SCHEMBL14076711 0.77 PRMT6 (0.43) NR3C2IGF1RTYK2NOS2LOXL2
SCHEMBL2643263 0.77 LOXL2 (0.52) NR3C2NOS2LOXLOXL2NOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9943603-B2 Coferons and methods of making and using them CORNELL UNIVERSITY (US) 2018-04-17 US disclosed