SCHEMBL6909874

SCHEMBL6909874

CN1C(=CC2=CC(=O)C(=O)c3ccccc32)Sc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.46
RAB9A P51151 10/20 0.46
POLB P06746 4/20 0.46
ALDH1A1 P00352 9/20 0.45
MAPT P10636 8/20 0.45
HPGD P15428 1/20 0.45
MAOA P21397 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HSD17B10 Q99714 2/20 0.42
PABPC1 P11940 1/20 0.42
SMN1; SMN2 Q16637 6/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
NFKB1 P19838 3/20 0.41
NFKB2 Q00653 3/20 0.41
RELA Q04206 3/20 0.41
TP53 P04637 3/20 0.41
PKM P14618 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
HTT P42858 2/20 0.41

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
SCHEMBL14435900 0.74 ALDH1A1 (0.48) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL11919638 0.73 NPC1 (0.43) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL28983466 0.72 NPC1 (0.47) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL30423061 0.71 NPC1 (0.46) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL13569244 0.70 MAPT (0.50) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL15726368 0.70 ALDH1A1 (0.44) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL13218858 0.69 MAPT (0.51) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL13084364 0.68 ALDH1A1 (0.48) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL30384077 0.68 NPC1 (0.43) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL13416589 0.68 MAOA (0.63) NPC1RAB9APOLBALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767809-B1 CURE-INDICATING MOLDING AND COATING COMPOSITION MINNESOTA MINING & MFG (US) 2004-01-21 EP disclosed
US-5596025-A POLYSILOXANE CURABLE BY HYDROSILATION REACTION, COLOR CHANGE ON CURING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-01-21 US disclosed
US-5583178-A ADDITION POLYMER AND A CURE INDICATING DYE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-12-10 US disclosed