SCHEMBL10470533

SCHEMBL10470533

Cc1cc2ccccc2[c]c1Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.37
TSHR P16473 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPK1 P28482 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTT P42858 3/20 0.34
LMNA P02545 2/20 0.33
BRD4 O60885 2/20 0.33
TDP1 Q9NUW8 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
SCHEMBL7879722 0.80 CYP2A6 (0.36) CYP1A2HPGDALDH1A1KDM4EBRD4
SCHEMBL10471230 0.79 LTA4H (0.37) LTA4HTSHRCYP1A2CYP2C19MEN1
SCHEMBL2459817 0.76 TLR8 (0.35) LTA4HTSHRSMN1; SMN2L3MBTL1MEN1
SCHEMBL9710751 0.76 CA1 (0.40) LTA4HTSHRCYP1A2CYP2C19SMN1; SMN2
SCHEMBL64492 0.75 BRD4 (0.39) TSHRCYP1A2HPGDALDH1A1HSD17B10
SCHEMBL2465788 0.69 LTA4H (0.41) LTA4HTSHRCYP1A2CYP2C19SMN1; SMN2
SCHEMBL9120143 0.69 PDE10A (0.42) CYP1A2SMN1; SMN2L3MBTL1HPGDMEN1
SCHEMBL1776822 0.68 CYP1A2 (0.38) TSHRCYP1A2HPGDMAPTALDH1A1
SCHEMBL1717201 0.68 BRD4 (0.37) CYP1A2HPGDMEN1KMT2AMAPT
SCHEMBL10822441 0.68 BRD4 (0.37) TSHRCYP1A2ALDH1A1HSD17B10BRD4

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
US-4895587-A Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1990-01-23 US disclosed
EP-0206251-B1 HALOACETAMIDE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1988-09-07 EP disclosed
EP-0206251-A1 Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1986-12-30 EP disclosed