SCHEMBL8932396

SCHEMBL8932396

O=C1NC(c2ccccc2)C(=O)NC1CO

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 3/20 0.41
LMNA P02545 2/20 0.40
ADORA3 P0DMS8 1/20 0.40
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GDA Q9Y2T3 1/20 0.37
USP2 O75604 1/20 0.37
MAPK10 P53779 1/20 0.37
CA2 P00918 1/20 0.37
CREBBP Q92793 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL1895535 0.82 MAPT (0.48) LMNAADORA3ALDH1A1MAPTKDM4E
SCHEMBL15669931 0.82 MAPT (0.48) LMNAADORA3ALDH1A1MAPTKDM4E
SCHEMBL1894049 0.82 MAPT (0.48) LMNAADORA3ALDH1A1MAPTKDM4E
SCHEMBL10466520 0.78 LMNA (0.41) LMNAADORA3ALDH1A1MAPTKDM4E
Methane SCHEMBL11336749 0.78 MAPT (0.48) LMNAADORA3ALDH1A1MAPTKDM4E
SCHEMBL17966437 0.78 HDAC8 (0.49) GAAGDA
SCHEMBL18769510 0.76 GAA (0.45) LMNAADORA3ALDH1A1MAPTKDM4E
Naphthalene SCHEMBL28102989 0.74 MAPT (0.46) LMNAADORA3ALDH1A1MAPTKDM4E
SCHEMBL10153089 0.72 CREBBP (0.41) LMNAADORA3ALDH1A1MAPTKDM4E
SCHEMBL10540567 0.72 SLC6A3 (0.56) ALDH1A1MAPTGAAHPGDKMT2A

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
WO-1996027370-A1 FREE RADICAL SCAVENGER MOLECULES BRITISH TECHNOLOGY GROUP LIMITED (GB) 1996-09-12 WO disclosed