SCHEMBL9017174

SCHEMBL9017174

CCCCN(CC)C(=O)n1nnn(-c2c(C)cccc2Cl)c1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.38
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
RXFP1 Q9HBX9 2/20 0.36
MEN1 O00255 1/20 0.36
BCL2 P10415 3/20 0.34
EGFR P00533 1/20 0.34
CRHR1 P34998 1/20 0.34
GAA P10253 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL9017170 1.00 HPGD (0.40) HPGDALDH1A1TSHRLMNAKMT2A
SCHEMBL9017057 0.94 KMT2A (0.36) HPGDALDH1A1TSHRLMNAKMT2A
SCHEMBL9017056 0.94 KMT2A (0.36) HPGDALDH1A1TSHRLMNAKMT2A
SCHEMBL8464960 0.91 KMT2A (0.39) ALDH1A1TSHRLMNAKMT2AGAA
SCHEMBL8464962 0.91 KMT2A (0.39) ALDH1A1TSHRLMNAKMT2AGAA
SCHEMBL8465090 0.89 KMT2A (0.37) ALDH1A1TSHRLMNAKMT2AGAA
SCHEMBL8465092 0.89 KMT2A (0.37) ALDH1A1TSHRLMNAKMT2AGAA
SCHEMBL9017132 0.87 P2RX4 (0.35) HPGDALDH1A1TSHRLMNATP53
SCHEMBL6816374 0.84 P2RX4 (0.37) HPGDALDH1A1TSHRLMNAKMT2A
SCHEMBL18820796 0.84 LMNA (0.40) HPGDALDH1A1TSHRLMNAKMT2A

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-0578090-B1 Tetrazolinones as herbicides for use in a rice paddy BAYER AGROCHEM KK (JP) 1996-12-27 EP disclosed
US-5466660-A Tetrazolinones as herbicides for use in paddy NIHON BAYER AGROCHEM K.K. (JP) 1995-11-14 US disclosed
US-5347010-A Tetrzolinone herbicides NIHON BAYER AGROCHEM K.K. (JP) 1994-09-13 US disclosed
EP-0578090-A2 Tetrazolinones as herbicides for use in a rice paddy NIHON BAYER AGROCHEM K.K. (JP) 1994-01-12 EP disclosed