SCHEMBL10533045

SCHEMBL10533045

COC(=O)C(C)=CC(=Cc1ccccc1)C=C(C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.56
HTT P42858 1/20 0.47
CYP2C9 P11712 1/20 0.45
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
APEX1 P27695 1/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 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
SCHEMBL9577533 0.88 AKR1C3 (0.70) AKR1C3HTTCYP2C9RECQLMEN1
SCHEMBL2060032 0.85 AKR1C3 (0.53) AKR1C3HTTCYP2C9RECQLMEN1
SCHEMBL22091933 0.83 AKR1C3 (0.58) AKR1C3HTTCYP2C9RECQLMEN1
SCHEMBL464969 0.81 AKR1C3 (0.64) AKR1C3HTTRECQLMEN1KMT2A
SCHEMBL12276505 0.81 AKR1C3 (0.64) AKR1C3HTTRECQLMEN1KMT2A
SCHEMBL522434 0.81 AKR1C3 (0.64) AKR1C3HTTRECQLMEN1KMT2A
SCHEMBL2060119 0.79 AKR1C3 (0.46) AKR1C3HTTCYP2C9MEN1KMT2A
SCHEMBL1456939 0.78 AKR1C3 (0.59) AKR1C3HTTCYP2C9RECQLMEN1
SCHEMBL186692 0.78 AKR1C3 (0.59) AKR1C3HTTCYP2C9RECQLLMNA
SCHEMBL5163102 0.77 AKR1C3 (0.54) AKR1C3HTTCYP2C9RECQLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4857574-A SMOOTH AND GLOSSY FILM AKZO NV (NL) 1989-08-15 US claimed
EP-0172589-B1 DISPERSION OF ADDITION (CO)POLYMERS IN AN ORGANIC LIQUID AKZO N.V. (NL) 1988-11-23 EP claimed
US-4743643-A GRAFTING (METHY)STYRENE ONTO BUTADIENE POLYMER, PEROXIDE INITIATOR, COATING AKZO NV (NL) 1988-05-10 US claimed
EP-0172589-A1 Dispersion of addition (co)polymers in an organic liquid AKZO N.V. (NL) 1986-02-26 EP claimed
US-4857574-A SMOOTH AND GLOSSY FILM AKZO NV (NL) 1989-08-15 US disclosed
EP-0172589-B1 DISPERSION OF ADDITION (CO)POLYMERS IN AN ORGANIC LIQUID AKZO N.V. (NL) 1988-11-23 EP disclosed
US-4743643-A GRAFTING (METHY)STYRENE ONTO BUTADIENE POLYMER, PEROXIDE INITIATOR, COATING AKZO NV (NL) 1988-05-10 US disclosed
EP-0172589-A1 Dispersion of addition (co)polymers in an organic liquid AKZO N.V. (NL) 1986-02-26 EP disclosed