SCHEMBL9230737

SCHEMBL9230737

O=C(Cl)c1cccc(-c2ccccc2-c2cccc(C(=O)Cl)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.48
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
PTGER1 P34995 3/20 0.45
HDAC8 Q9BY41 1/20 0.44
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
CYP2C9 P11712 1/20 0.43
KAT6A Q92794 2/20 0.42
NR1H4 Q96RI1 1/20 0.41
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
FOLH1 Q04609 1/20 0.41
HSD17B14 Q9BPX1 1/20 0.41
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40
BAZ2A Q9UIF9 1/20 0.40
CNR2 P34972 1/20 0.39

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
SCHEMBL726087 0.87 KMO (0.56) KMOALDH1A1TSHRHDAC8RXRA
SCHEMBL699008 0.85 KMO (0.67) KMOALDH1A1TSHRHDAC8RXRA
SCHEMBL30698052 0.85 KMO (0.67) KMOALDH1A1TSHRHDAC8RXRA
SCHEMBL28032601 0.85 KMO (0.59) KMOALDH1A1TSHRHDAC8RXRA
Hydrogen Sulfide SCHEMBL27896825 0.83 KMO (0.64) KMOALDH1A1TSHRHDAC8RXRA
SCHEMBL7067814 0.83 SCN9A (0.50)
SCHEMBL2213546 0.81 KMO (0.73) KMOTSHRPTGER1RXRARXRB
SCHEMBL30259065 0.81 KMO (0.73) KMOTSHRPTGER1RXRARXRB
SCHEMBL27510 0.79 ALDH1A1 (0.59) KMOALDH1A1TSHRHDAC8ATM
SCHEMBL1707626 0.79 KMO (0.70) KMOTSHRPTGER1RXRARXRB

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-5393612-A Conductor and insulating coating having tensile strength of at least 13 kg/mm2 SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1995-02-28 US disclosed