SCHEMBL7716671

SCHEMBL7716671

Cc1ccc(C(=O)NN)c(OC(=O)C(=O)Oc2cc(C)ccc2C(=O)NN)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.51
ALDH1A1 P00352 4/20 0.44
GFER P55789 1/20 0.42
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 2/20 0.40
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
P2RX7 Q99572 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
KCNMA1 Q12791 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PLG P00747 1/20 0.38
KLK1 P06870 1/20 0.38
KLK6 Q92876 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL4333687 0.85 CTSD (0.67) CTSDALDH1A1MAPTKDM4EKMT2A
SCHEMBL3234937 0.80 CTSD (0.44) CTSDALDH1A1MAPTKDM4EKMT2A
SCHEMBL7717830 0.78 NPC1 (0.48) CTSDALDH1A1GFERMAPTKDM4E
SCHEMBL10562342 0.78 ALDH1A1 (0.50) CTSDALDH1A1GFERMAPTKDM4E
SCHEMBL5504399 0.77 SMN1; SMN2 (0.58) CTSDALDH1A1GFERMAPTKDM4E
SCHEMBL21551646 0.76 TSHR (0.53) MAPTLMNAHTTNPC1HSD17B10
SCHEMBL7748621 0.75 CTSD (0.68) CTSDALDH1A1MAPTKDM4EKMT2A
SCHEMBL27975487 0.75 ALDH1A1 (0.67) ALDH1A1GFERMAPTKDM4EKMT2A
Hydrochloric Acid SCHEMBL19547889 0.75 SMN1; SMN2 (0.57) ALDH1A1GFERMAPTKDM4EKMT2A
SCHEMBL15047177 0.74 LOXL2 (0.55) CTSDALDH1A1GFERMAPTKDM4E

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
US-6384007-B1 INTENSIFERS FOR OXIDATION OF PHENOL WITH ENZYMES AND HYDRAZINE COMPOUNDS UNILEVER HOME & PERSONAL USA DIVISION OF CONOPCO, INC. 2002-05-07 US claimed
US-6384007-B1 INTENSIFERS FOR OXIDATION OF PHENOL WITH ENZYMES AND HYDRAZINE COMPOUNDS UNILEVER HOME & PERSONAL USA DIVISION OF CONOPCO, INC. 2002-05-07 US disclosed