SCHEMBL28351306

SCHEMBL28351306

C=Cc1ccc(CCC(=O)OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.49
CYP4A11 Q02928 3/20 0.49
ADRB2 P07550 1/20 0.48
ADRB1 P08588 1/20 0.48
F2RL1 P55085 1/20 0.45
CYP4Z1 Q86W10 1/20 0.44
IDO1 P14902 1/20 0.44
EPHX2 P34913 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CA12 O43570 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL10859661 0.90 CYP4Z1 (0.47) CYP4F2CYP4A11CYP4Z1EPHX2ALDH1A1
SCHEMBL22922181 0.85 CYP4F2 (0.59) CYP4F2CYP4A11ADRB2ADRB1F2RL1
SCHEMBL6777451 0.85 CYP4F2 (0.68) CYP4F2CYP4A11CYP4Z1EPHX2HRH3
SCHEMBL697461 0.84 CYP4F2 (0.50) CYP4F2CYP4A11ADRB2ADRB1F2RL1
SCHEMBL2551765 0.83 ALDH1A1 (0.50) CYP4F2CYP4A11ADRB2ADRB1F2RL1
SCHEMBL6257338 0.82 CYP4F2 (0.58) CYP4F2CYP4A11ALDH1A1LMNAMAPT
SCHEMBL6783982 0.82 CYP4F2 (0.44) CYP4F2CYP4A11ADRB2ADRB1CYP4Z1
SCHEMBL13310807 0.81 KMT2A (0.51) CYP4F2CYP4A11F2RL1ALDH1A1LMNA
SCHEMBL7990664 0.80 CYP4F2 (0.50) CYP4F2CYP4A11ADRB2ADRB1F2RL1
SCHEMBL10072449 0.80 ALDH1A1 (0.57) CYP4F2CYP4A11ALDH1A1LMNAMAPT

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-104880908-B Photosensitive resin composition 住友化学株式会社 2019-12-13 CN disclosed