SCHEMBL7784037

SCHEMBL7784037

COC(=O)c1cc2c(OC)c(OC)ccc2c2c1C=CC(c1ccccc1)(c1ccc(N3CCCCC3)cc1)O2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GFER P55789 2/20 0.38
AHR P35869 1/20 0.38
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
L3MBTL1 Q9Y468 5/20 0.36
PABPC1 P11940 1/20 0.36
GAA P10253 2/20 0.35
HIF1A Q16665 3/20 0.35
USP2 O75604 1/20 0.35
KDM4E B2RXH2 3/20 0.34
TP53 P04637 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL4797063 0.89 KDM4E (0.37) MEN1KMT2AL3MBTL1GAAHIF1A
SCHEMBL7785460 0.87 MAPT (0.39) MAPTRAB9ANPC1SMN1; SMN2GFER
SCHEMBL5422759 0.86 NPSR1 (0.35) MAPTSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL4795527 0.86 EIF4A1 (0.37) KMT2AHIF1AKDM4EALDH1A1
SCHEMBL14629673 0.86 HIF1A (0.38) MAPTRAB9ANPC1SMN1; SMN2GFER
SCHEMBL7777302 0.85 DHODH (0.37) MAPTRAB9ANPC1SMN1; SMN2GFER
SCHEMBL7784131 0.85 MAPT (0.39) MAPTRAB9ANPC1SMN1; SMN2GFER
SCHEMBL27748008 0.83 HIF1A (0.35) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL5549293 0.83 MAPT (0.39) MAPTRAB9ANPC1SMN1; SMN2GFER
SCHEMBL5435358 0.83 KMT2A (0.37) KMT2AL3MBTL1HIF1AKDM4EALDH1A1

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
EP-1140892-A1 PHOTOCHROMIC SUBSTIITUTED 2H-NAPHTHO[1,2-B]PYRANS JAMES ROBINSON LIMITED (GB) 2001-10-10 EP disclosed
WO-2000035902-A1 PHOTOCHROMIC SUBSTITUTED 2H-NAPHTHO[1,2-b]PYRANS JAMES ROBINSON LIMITED (GB) 2000-06-22 WO disclosed