SCHEMBL7229458

SCHEMBL7229458

COC(=O)CCOc1ccnc(Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
DYRK1A Q13627 1/20 0.41
LTB4R Q15722 1/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 3/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PLAAT3 P53816 1/20 0.37
PLAAT5 Q96KN8 1/20 0.37
PLAAT2 Q9NWW9 1/20 0.37
PLAAT4 Q9UL19 1/20 0.37
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 2/20 0.36
PRNP P04156 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CYP1A2 P05177 1/20 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
SCHEMBL2017242 0.76 TSHR (0.39) DYRK1AALDH1A1SMN1; SMN2HTTHSD17B10
SCHEMBL22576451 0.75 HTT (0.39) DYRK1AALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL2016297 0.75 HTT (0.39) MAPTDYRK1AALDH1A1SMN1; SMN2KMT2A
SCHEMBL24258741 0.75 HPGD (0.44) MAPTLTB4RALDH1A1SMN1; SMN2ABL1
SCHEMBL16885185 0.74 NUDT1 (0.37) MAPTALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL2014330 0.74 RECQL (0.38) ALDH1A1KMT2APLAAT3PLAAT5PLAAT2
SCHEMBL3059054 0.74 MAPT (0.36) MAPTSMN1; SMN2KMT2APLAAT3PLAAT5
SCHEMBL17618001 0.74 ALDH1A1 (0.45) MAPTALDH1A1SMN1; SMN2KMT2AHSD17B10
SCHEMBL31637815 0.74 HTR7 (0.55) MAPTDYRK1ALTB4RALDH1A1SMN1; SMN2
SCHEMBL23291726 0.74 HTR7 (0.55) MAPTDYRK1ALTB4RALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6537948-B1 Have a wide range of herbicidal spectrum, and causes no phytotoxicity on crops SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-25 US disclosed