SCHEMBL8636800

SCHEMBL8636800

CCON(C(=O)OC)c1ccccc1CBr

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2D6 P10635 2/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
TSHR P16473 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
TP53 P04637 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32

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
SCHEMBL1461137 0.86 ALDH1A1 (0.36) ALDH1A1LMNAKDM4ETSHRMEN1
SCHEMBL8634893 0.81 LMNA (0.47) ALDH1A1LMNAKDM4ETSHRCYP3A4
SCHEMBL8174632 0.79 LMNA (0.39) ALDH1A1LMNAKDM4ETSHRCYP3A4
SCHEMBL7601778 0.79 TP53 (0.35) ALDH1A1LMNAKDM4ESMN1; SMN2CYP2D6
SCHEMBL28593004 0.78 KDM4E (0.38) ALDH1A1LMNAKDM4ETSHRKMT2A
SCHEMBL10061323 0.76 PTGER1 (0.37) ALDH1A1LMNATSHRTP53MEN1
SCHEMBL3567302 0.75 CES2 (0.36) ALDH1A1LMNAKDM4ESMN1; SMN2TSHR
SCHEMBL14351893 0.73 APP (0.43) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL13499618 0.73 PPARD (0.39) ALDH1A1LMNAKMT2A
SCHEMBL7602423 0.72 KDM4E (0.33) ALDH1A1LMNAKDM4ETSHRMEN1

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 5 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
EP-0619301-A2 N-Substituted phennylcarbamic acid derivates a process for production thereof, and agricultural and horticultural fungicides NIHON NOHYAKU CO., LTD. (JP) 1994-10-12 EP disclosed