SCHEMBL7048508

SCHEMBL7048508

CSc1ccccc1C[NH]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.48
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SLC6A2 P23975 4/20 0.39
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 3/20 0.39
LMNA P02545 2/20 0.38
APOBEC3G Q9HC16 1/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CHRM4 P08173 1/20 0.34
HTR7 P34969 1/20 0.34
P2RX7 Q99572 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ADRA1D P25100 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
SCHEMBL9209214 0.80 CHRM2 (0.44) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
Hydrochloric Acid SCHEMBL6638579 0.79 SLC6A2 (0.47) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL8481321 0.78 CHRM2 (0.50) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL5179196 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL515497 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL4801748 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL2048982 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL2169643 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL1146142 0.76 APOBEC3G (0.67) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2
SCHEMBL5179203 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1SLC6A2

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