SCHEMBL20062909

SCHEMBL20062909

CCc1cc(N2C(=C3N(c4cc(CC)nc(CC)c4)c4ccccc4N3c3cc(CC)nc(CC)c3)N(c3cc(CC)nc(CC)c3)c3ccccc32)cc(CC)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
CHRM1 P11229 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
MGLL Q99685 1/20 0.35
PKM P14618 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL20062911 0.79 SCN10A (0.32)
SCHEMBL20071946 0.76 MAT2A (0.32) MAT2AGRIN2DGRIN3BCHRM1ADRA1D
SCHEMBL20062910 0.75 CYP1A2 (0.35) TSHRHTTHSD17B10CYP1A2CYP2A6
SCHEMBL18905661 0.73 MGLL (0.42) MGLLTSHRHSD17B10LMNA
SCHEMBL20062915 0.70 HPGD (0.38) TSHRHSD17B10LMNA
SCHEMBL18905737 0.70 MAPT (0.45) MGLLHTTLMNA
SCHEMBL18905658 0.67 MGLL (0.40) GRIN1GRIN2BMGLLTSHRHSD17B10
SCHEMBL18905645 0.65 GABRA1 (0.37) LMNA
SCHEMBL18905646 0.65 MGLL (0.34) MGLLPKMTDP1HTTLMNA
SCHEMBL18905734 0.65 ELANE (0.44) MGLLHSD17B10

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-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed