Ethylene

Ethylene

SCHEMBL8647235

C=C.O=C1CN(C(CCCl)c2ccccc2)S(=O)(=O)c2ccccc21

nearest known ligand 0.49

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.49
KMT2A Q03164 5/20 0.42
CTDSP1 Q9GZU7 2/20 0.42
MDM2 Q00987 1/20 0.42
MAPT P10636 1/20 0.40
ELANE P08246 1/20 0.39
CA12 O43570 5/20 0.37
CA9 Q16790 4/20 0.37
CA2 P00918 2/20 0.36
FBP1 P09467 1/20 0.36
MEN1 O00255 3/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD11B1 P28845 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL8644361 0.97 TDP1 (0.51) TDP1KMT2ACTDSP1MDM2MAPT
SCHEMBL8643783 0.80 TDP1 (0.43) TDP1KMT2ACTDSP1MDM2NPC1
SCHEMBL8646569 0.80 TDP1 (0.43) TDP1KMT2ACTDSP1MDM2CA12
Hydrochloric Acid SCHEMBL8648190 0.79 TDP1 (0.43) TDP1KMT2ACTDSP1MDM2NPC1
Hydrochloric Acid SCHEMBL8647131 0.79 TDP1 (0.43) TDP1KMT2ACTDSP1MDM2CA12
SCHEMBL8651129 0.78 TDP1 (0.42) TDP1KMT2ACTDSP1MDM2CA12
SCHEMBL8644541 0.78 ACHE (0.46) TDP1KMT2ACTDSP1MDM2
Hydrochloric Acid SCHEMBL8646984 0.78 ACHE (0.46) TDP1KMT2ACTDSP1MDM2
Hydrochloric Acid SCHEMBL8644143 0.78 TDP1 (0.41) TDP1KMT2ACTDSP1MDM2CA9
SCHEMBL8645472 0.73 DRD2 (0.42) TDP1KMT2AMAPTCA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773437-A UROGENITAL DISORDERS SUCH AS DYSURIA NIPPON CHEMIPHAR CO., LTD. (JP) 1998-06-30 US disclosed
EP-0753514-A1 ALKYLENEDIAMINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-01-15 EP disclosed