SCHEMBL7785460

SCHEMBL7785460

COC(=O)c1cc2cc(OC)c(OC)cc2c2c1C=CC(c1ccccc1)(c1ccc(N3CCCCC3)cc1)O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
GFER P55789 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
AHR P35869 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
HCRTR1 O43613 1/20 0.39
PDE1A P54750 2/20 0.39
PDE1B Q01064 2/20 0.39
PDE1C Q14123 2/20 0.39
GAA P10253 2/20 0.38
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
TP53 P04637 2/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
HIF1A Q16665 3/20 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
SCHEMBL7777302 0.90 DHODH (0.37) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL7784131 0.89 MAPT (0.39) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL5549293 0.89 MAPT (0.39) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL6131938 0.89 DHODH (0.40) MAPTKMT2AMEN1PDE1APDE1B
SCHEMBL7784037 0.87 MAPT (0.38) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL891063 0.86 LRP6 (0.33) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL6131929 0.86 KMT2A (0.39) NPC1KMT2AMEN1PDE1APDE1B
SCHEMBL15693690 0.85 DHODH (0.35) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL7473791 0.85 NPC1 (0.33) MAPTRAB9ANPC1GFERSMN1; SMN2
SCHEMBL12907868 0.85 HTR6 (0.36) MAPTRAB9ANPC1GFERSMN1; SMN2

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