SCHEMBL6915501

SCHEMBL6915501

CC1=CC(=Nc2ccc(N3CCOCC3)cc2)C=CC1=O.O=C1C(Cl)=CC(=Nc2ccc(N3CCOCC3)cc2)C=C1Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
MAPT P10636 9/20 0.36
HTT P42858 4/20 0.36
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
STAT3 P40763 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
MAPK1 P28482 3/20 0.35
KDM4E B2RXH2 2/20 0.35
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 4/20 0.35
USP2 O75604 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HPGD P15428 1/20 0.35
RAD51 Q06609 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
SCHEMBL6915497 1.00 MEN1 (0.38) MEN1KMT2AMAPTHTTTP53
SCHEMBL5509572 0.91 MAPT (0.42) MEN1KMT2AMAPTHTTTP53
SCHEMBL5509576 0.91 MAPT (0.42) MEN1KMT2AMAPTHTTTP53
SCHEMBL5510869 0.87 MAPT (0.41) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL5518152 0.82 MAPT (0.45) MEN1KMT2AMAPTHTTTP53
SCHEMBL8850269 0.70 MAPT (0.45) MEN1KMT2AMAPTHTTTP53
SCHEMBL5506405 0.70 MAPT (0.45) MEN1KMT2AMAPTHTTTP53
SCHEMBL11627606 0.67 MAPT (0.43) MEN1KMT2AMAPTHTTTP53
SCHEMBL11628176 0.66 MAPT (0.40) MEN1KMT2AMAPTHTTTP53
SCHEMBL2680700 0.64 PABPC1 (0.56) MEN1KMT2AMAPTHTTTP53

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
EP-0767809-B1 CURE-INDICATING MOLDING AND COATING COMPOSITION MINNESOTA MINING & MFG (US) 2004-01-21 EP claimed