SCHEMBL7051934

SCHEMBL7051934

CN(C)c1cccc(C[NH])c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
TSHR P16473 2/20 0.48
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NOS1 P29475 2/20 0.42
CHKA P35790 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
APP P05067 1/20 0.41
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.41
CNR1 P21554 1/20 0.39
MAPT P10636 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HSD17B1 P14061 1/20 0.37

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
SCHEMBL11861528 0.82 HDAC1 (0.60) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL129446 0.80 SIGMAR1 (0.51) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL30966769 0.80 SIGMAR1 (0.51) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL1295097 0.79 HDAC1 (0.46) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL3354502 0.79 ALDH1A1 (0.48) ALDH1A1KMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL24687861 0.78 ALDH1A1 (0.48) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL27332 0.78 ALDH1A1 (0.54) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL18818617 0.78 ALDH1A1 (0.48) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL21847308 0.78 ALDH1A1 (0.48) ALDH1A1TSHRHDAC1HDAC6KMT2A
SCHEMBL2536856 0.78 ALDH1A1 (0.48) ALDH1A1TSHRHDAC1HDAC6KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882715-B1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA CHEMICAL IND CO LTD (JP) 2003-04-23 EP disclosed
US-6339045-B1 CAN BE USED IN A SMALL AMOUNT, SHOWING A GOOD SELECTIVITY BETWEEN CROP AND WEED, AND CAUSING NO PHYTOTOXICITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-01-15 US disclosed
EP-0882715-A1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed