SCHEMBL11570524

SCHEMBL11570524

CC(=O)CC(=O)NC1CCCCCCC1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.60
EPHX1 P07099 6/20 0.59
HPGD P15428 2/20 0.59
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.57
ALDH1A1 P00352 2/20 0.57
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
EPHX2 P34913 2/20 0.54
MAPT P10636 1/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP3A4 P08684 1/20 0.54
LMNA P02545 1/20 0.53

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
SCHEMBL2413616 1.00 NPSR1 (0.60) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL11569599 1.00 NPSR1 (0.60) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL2412758 0.98 SMN1; SMN2 (0.59) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL2416229 0.93 SMN1; SMN2 (0.54) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL2417389 0.89 SMN1; SMN2 (0.46) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL16922982 0.89 SMN1; SMN2 (0.46) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL3075216 0.86 EPHX1 (0.68) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL9381361 0.83 ALDH1A1 (0.55) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL20053080 0.82 KMT2A (0.54) NPSR1EPHX1HPGDKMT2ASMN1; SMN2
SCHEMBL14890449 0.81 EPHX2 (0.56) NPSR1EPHX1HPGDKMT2ASMN1; SMN2

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
US-4170465-A PRE- AND POST- EMERGENCE HERBICIDES ROUSSEL UCLAF (FR) 1979-10-09 US disclosed