SCHEMBL8993857

SCHEMBL8993857

O=C(O)NC(=Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.50
AKR1C1 Q04828 1/20 0.48
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RECQL P46063 1/20 0.43
TP53 P04637 1/20 0.42
HTT P42858 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
TSHR P16473 1/20 0.41
HAO1 Q9UJM8 1/20 0.40
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40

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
SCHEMBL388142 0.84 AKR1C3 (0.57) AKR1C3AKR1C1ALDH1A1LMNAMEN1
SCHEMBL786716 0.84 AKR1C3 (0.57) AKR1C3AKR1C1ALDH1A1LMNAMEN1
SCHEMBL388143 0.84 AKR1C3 (0.57) AKR1C3AKR1C1ALDH1A1LMNAMEN1
SCHEMBL1942389 0.82 MAPT (0.57) AKR1C1ALDH1A1LMNAMEN1KMT2A
Methyl Alcohol SCHEMBL8740650 0.82 AKR1C3 (0.55) AKR1C3AKR1C1ALDH1A1MEN1KMT2A
SCHEMBL1942388 0.82 MAPT (0.57) AKR1C1ALDH1A1LMNAMEN1KMT2A
SCHEMBL7112204 0.82 MAPT (0.57) AKR1C1ALDH1A1LMNAMEN1KMT2A
SCHEMBL387760 0.82 AKR1C3 (0.55) AKR1C3AKR1C1ALDH1A1MEN1KMT2A
SCHEMBL12394377 0.81 ALDH1A1 (0.50) AKR1C3AKR1C1ALDH1A1LMNAMEN1
SCHEMBL14135332 0.81 AKR1C3 (0.48) AKR1C3AKR1C1CYP3A4CYP2C9ALDH1A1

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
EP-0607962-B1 Photosensitive resin composition JAPAN SYNTHETIC RUBBER CO LTD (JP) 1996-07-17 EP disclosed
EP-0607962-A1 Photosensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1994-07-27 EP disclosed