SCHEMBL7104600

SCHEMBL7104600

COC(=O)c1c2ccccc2nc2cc(O)ccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.57
KMT2A Q03164 7/20 0.57
KDM4E B2RXH2 9/20 0.52
MAPT P10636 8/20 0.52
POLB P06746 7/20 0.52
ALDH1A1 P00352 4/20 0.52
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
PKM P14618 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
ALOX15 P16050 1/20 0.48
CYP2C19 P33261 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GAA P10253 7/20 0.47
HTT P42858 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GFER P55789 2/20 0.47

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
SCHEMBL2443270 0.87 MEN1 (0.71) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL38662586 0.87 MEN1 (0.71) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL10091835 0.84 CA12 (0.49) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL7536012 0.84 KMT2A (0.56) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL11778609 0.84 PLA2G2A (0.56) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL3902074 0.83 DHODH (0.55) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL12088076 0.79 MEN1 (0.48) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL28129469 0.79 MEN1 (0.60) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL13985402 0.78 TRPV1 (0.45) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL11775249 0.78 PLA2G2A (0.67) MEN1KMT2AKDM4EMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988551-B1 CHEMILUMINESCENT ENERGY TRANSFER CONJUGATES AND THEIR USES AS LABELS IN BINDING ASSAYS BAYER AG (US) 2003-09-10 EP disclosed
US-6165800-A Chemiluminescent energy transfer conjugates and their uses as labels in binding assays BAYER CORPORATION (US) 2000-12-26 US disclosed
EP-0988551-A2 CHEMILUMINESCENT ENERGY TRANSFER CONJUGATES AND THEIR USES AS LABELS IN BINDING ASSAYS Bayer Corporation (US) 2000-03-29 EP disclosed
WO-1998054574-A2 CHEMILUMINESCENT ENERGY TRANSFER CONJUGATES AND THEIR USES AS LABELS IN BINDING ASSAYS BAYER CORPORATION (US) 1998-12-03 WO disclosed