SCHEMBL8657294

SCHEMBL8657294

Cc1nn(CO)c(C)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.59
ALDH1A1 P00352 4/20 0.57
CYP1A1 P04798 1/20 0.44
KMT2A Q03164 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ENPP3 O14638 3/20 0.37
ALPL P05186 3/20 0.37
XIAP P98170 3/20 0.37
ENPP1 P22413 2/20 0.37
ELANE P08246 1/20 0.37
MEN1 O00255 3/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
POLB P06746 2/20 0.37
USP2 O75604 1/20 0.37
HSP90AA1 P07900 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 2/20 0.36

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
SCHEMBL13180563 0.79 GLS (0.61) GLSALDH1A1CYP1A1KMT2AL3MBTL1
SCHEMBL3472325 0.76 GLS (0.68) GLSALDH1A1CYP1A1KMT2AL3MBTL1
SCHEMBL111808 0.75 ALDH1A1 (0.67) GLSALDH1A1CYP1A1KMT2AL3MBTL1
SCHEMBL8660934 0.73 APAF1 (0.53) ALDH1A1MAPTMAPK1USP2TSHR
SCHEMBL8659165 0.73 ALDH1A1 (0.35) GLSALDH1A1
SCHEMBL13024308 0.70 TSHR (0.49) GLSALDH1A1KMT2AMAPTMAPK1
SCHEMBL11186176 0.69 GLS (0.45) GLSALDH1A1CYP1A1KMT2AL3MBTL1
SCHEMBL11185742 0.69 GLS (0.58) GLSALDH1A1CYP1A1KMT2AL3MBTL1
SCHEMBL18021086 0.68 KDM4E (0.36) ALDH1A1KMT2ATSHRLMNAKDM4E
SCHEMBL14959215 0.67 KMT2A (0.60) ALDH1A1KMT2AL3MBTL1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467707-A1 Process for the preparation of 1-Hydroxymethylpyrazoles BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1992-01-22 EP claimed
EP-0467708-B1 Control of microorganisms on plants with 1-hydroxymethylpyrazoles BUCKMAN LABOR INC (US) 1998-11-04 EP disclosed
EP-0320309-B1 Control of microorganisms in aqueous systems with 1-hydroxymethylpyrazoles BUCKMAN LABOR INC (US) 1994-07-27 EP disclosed
EP-0467707-A1 Process for the preparation of 1-Hydroxymethylpyrazoles BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1992-01-22 EP disclosed
EP-0320309-A2 Control of microorganisms in aqueous systems with 1-hydroxymethylpyrazoles BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1989-06-14 EP disclosed
US-4801362-A Control of microorganisms in aqueous systems with 1-hydroxymethylpyrazoles BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1989-01-31 US disclosed
US-4657577-A LOW DOSAGE, GRASSES, WEEDS BAYER AKTIENGESELLSCHAFT (DE) 1987-04-14 US disclosed
US-4585870-A POSTEMERGENCE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1986-04-29 US disclosed
US-4518416-A Certain trimethyl silyl-lower-alkyl esters of pyridyloxy-phenoxy-lower alkanoic acids, compositions containing same and herbicidal method of use BAYER AKTIENGESELLSCHAFT (DE) 1985-05-21 US disclosed
EP-0096354-A1 Substituted pyridyl-phenyl ethers BAYER AG (DE) 1983-12-21 EP disclosed
US-4402727-A Substituted azolylalkyl phenoxyphenoxyalkane-carboxylates as herbicides and plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 1983-09-06 US disclosed
EP-0073880-A2 Substituted phenoxyphenoxyalkanecarbonacid-azolyl-alkyl esters, process for their preparation and their use as herbicides and plant growth regulators BAYER AG (DE) 1983-03-16 EP disclosed
EP-0070990-A2 Substituted phenoxybenzoic acid-azolylalkyl esters, process for their preparation and their herbicidal application BAYER AG (DE) 1983-02-09 EP disclosed