Ethylene

Ethylene

SCHEMBL8378337

C=C.O=C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.60
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA7 P43166 1/20 0.59
CA9 Q16790 1/20 0.59
CA14 Q9ULX7 1/20 0.59
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
POLB P06746 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HSD11B1 P28845 1/20 0.53
MGLL Q99685 1/20 0.53
ATM Q13315 1/20 0.52
HTT P42858 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
EPHX2 P34913 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL12626192 0.97 HPGD (0.63) HPGDCA12CA1CA2CA7
SCHEMBL9152022 0.85 CA12 (0.77) HPGDCA12CA1CA2CA7
SCHEMBL4724436 0.82 KMT2A (0.75) HPGDCA12CA1CA2CA7
SCHEMBL1877246 0.82 KMT2A (0.80) HPGDCA12CA1CA2CA7
SCHEMBL4499205 0.82 HPGD (0.86) HPGDCA12CA1CA2CA7
SCHEMBL24120195 0.82 HPGD (0.61) HPGDKMT2AMEN1POLBSMN1; SMN2
SCHEMBL1590712 0.81 KMT2A (0.83) HPGDCA12CA1CA2CA7
SCHEMBL27971693 0.81 CA12 (0.70) HPGDCA12CA1CA2CA7
SCHEMBL142197 0.80 CA12 (0.68) HPGDCA12CA1CA2CA7
SCHEMBL28866336 0.80 CA12 (0.64) HPGDCA12CA1CA2CA7

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-5883102-A Pharmaceutically active compounds ASTRA PHARMACEUTICALS LIMITED (GB) 1999-03-16 US disclosed