SCHEMBL8637901

SCHEMBL8637901

CC(=O)NN=C(C)c1cccc(F)c1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.66
MEN1 O00255 3/20 0.66
MAPT P10636 3/20 0.61
MTOR P42345 2/20 0.56
KDM4E B2RXH2 1/20 0.55
GAA P10253 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
NPC1 O15118 3/20 0.50
RAB9A P51151 2/20 0.50
POLB P06746 2/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PARP1 P09874 1/20 0.49

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
SCHEMBL8637896 1.00 KMT2A (0.66) KMT2AMEN1MAPTMTORKDM4E
SCHEMBL940507 0.81 CTSL (0.72) ALDH1A1
SCHEMBL8633080 0.80 SMN1; SMN2 (0.77) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL8633084 0.80 SMN1; SMN2 (0.77) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL30826115 0.79 MAPT (0.67) KMT2AMEN1MAPTMTORKDM4E
SCHEMBL27177975 0.79 MAPT (0.67) KMT2AMEN1MAPTMTORKDM4E
SCHEMBL12443317 0.79 MAPT (0.67) KMT2AMEN1MAPTMTORKDM4E
SCHEMBL30826098 0.79 MAPT (0.67) KMT2AMEN1MAPTMTORKDM4E
SCHEMBL27177943 0.79 MAPT (0.67) KMT2AMEN1MAPTMTORKDM4E
SCHEMBL12186262 0.78 MAPT (0.78) KMT2AMEN1MAPTKDM4EGAA

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-0704430-B1 N-substituted phenylcarbamic acid derivatives, a process for production thereof, agricultural and horticultural fungicides, intermediates of the derivatives and a process for production thereof NIHON NOHYAKU CO LTD (JP) 1998-07-29 EP disclosed
US-5712399-A N-substituted phenylcarbamic acid derivatives, a process for production thereof, agricultural and horticultural fungicides, intermediates of the derivatives and a process for production thereof NIHON NOHYAKU CO., LTD. (JP) 1998-01-27 US disclosed
US-5650434-A FUNGICIDES NIHON NOHYAKU CO., LTD. (JP) 1997-07-22 US disclosed
EP-0704430-A1 N-substituted phenylcarbamic acid derivatives, a process for production thereof, agricultural and horticultural fungicides, intermediates of the derivatives and a process for production thereof NIHON NOHYAKU CO., LTD. (JP) 1996-04-03 EP disclosed