Methylene Chloride

Methylene Chloride

SCHEMBL28345680

CCC(=O)c1ccc2ccc3cccc4ccc1c2c34.ClCCl

nearest known ligand 0.60

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.60
KMT2A Q03164 6/20 0.60
HPGD P15428 5/20 0.60
HSD17B10 Q99714 5/20 0.60
CYP1A2 P05177 5/20 0.60
KDM4E B2RXH2 4/20 0.60
POLB P06746 2/20 0.60
CYP2D6 P10635 2/20 0.60
GLA P06280 1/20 0.60
MAPT P10636 2/20 0.44
MEN1 O00255 5/20 0.42
TSHR P16473 4/20 0.42
CYP3A4 P08684 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
CYP1A1 P04798 2/20 0.40
CYP1B1 Q16678 2/20 0.40
HSP90AB1 P08238 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
PTPN1 P18031 1/20 0.37

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
SCHEMBL8584989 0.95 ALDH1A1 (0.66) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL28270088 0.85 ALDH1A1 (0.66) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL2123580 0.83 HPGD (0.73) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL17709257 0.80 ALDH1A1 (0.68) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL11597738 0.79 ALDH1A1 (0.62) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL4947049 0.78 HPGD (0.47) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL19373770 0.78 ALDH1A1 (0.57) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL16581128 0.78 ALDH1A1 (0.66) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL9359566 0.78 ALDH1A1 (0.66) ALDH1A1KMT2AHPGDHSD17B10CYP1A2
SCHEMBL29677028 0.78 ALDH1A1 (0.66) ALDH1A1KMT2AHPGDHSD17B10CYP1A2

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
CN-110511186-A The ratio fluorescent probe that a kind of pair of membrane charge responds and its application in Bacteria Detection DALIAN INST CHEM & PHYSICS CAS 2019-11-29 CN claimed