SCHEMBL7258652

SCHEMBL7258652

CC(C)(C)c1ccc(Oc2ccc(C(C)(C)C)c(N)c2)cc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.54
ALDH1A1 P00352 9/20 0.45
MAPT P10636 6/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
ESRRA P11474 2/20 0.41
SMN1; SMN2 Q16637 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 3/20 0.39
MITF O75030 1/20 0.39
GFER P55789 1/20 0.39
NLRP1 Q9C000 1/20 0.39
NOD2 Q9HC29 1/20 0.39
TDP1 Q9NUW8 3/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
THRB P10828 2/20 0.36

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
SCHEMBL19251044 0.85 ALDH1A1 (0.53) ALDH1A1MAPTMAPK1SMN1; SMN2MEN1
SCHEMBL5381392 0.83 NR4A1 (0.54) NR4A1ALDH1A1MAPTNPC1RAB9A
SCHEMBL13474892 0.79 ESRRA (0.49) NR4A1ALDH1A1MAPTNPC1RAB9A
SCHEMBL8178499 0.78 NR4A1 (0.54) NR4A1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL28643962 0.77 MEN1 (0.48) ALDH1A1MAPTESRRAMEN1KMT2A
SCHEMBL8144954 0.77 NR4A1 (0.52) NR4A1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL15958889 0.76 ALDH1A1 (0.39) ALDH1A1MAPTMAPK1
SCHEMBL19438416 0.75 NR1H4 (0.43) ALDH1A1MAPTESRRASMN1; SMN2MEN1
SCHEMBL398357 0.75 CASP1 (0.48) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL12666667 0.74 CHRNB2 (0.50) ALDH1A1MAPTMAPK1GAAKDM4E

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-6646040-B1 Intermediate transfer member of image forming apparatus having polyimide resin film containing oxidized carbon black; uniform electrical resistance FUJI XEROX CO., LTD. (JP) 2003-11-11 US disclosed
EP-0120130-A1 Polyetherimide bearing compositions GENERAL ELECTRIC COMPANY (US) 1984-10-03 EP disclosed