SCHEMBL3422780

SCHEMBL3422780

C/C(=C\c1cccc(O)c1/C=C(\C)C(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.48
IAPP P10997 2/20 0.42
ERN1 O75460 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.39
APEX1 P27695 8/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
NFKB1 P19838 1/20 0.38
CA4 P22748 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CA12 O43570 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35

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
SCHEMBL1094265 1.00 AKR1C3 (0.48) AKR1C3IAPPERN1LMNAMAPT
SCHEMBL9861346 0.90 ERN1 (0.52) AKR1C3IAPPERN1LMNAMAPT
SCHEMBL8746654 0.89 AKR1C3 (0.55) AKR1C3APEX1KDM4E
SCHEMBL8746657 0.89 AKR1C3 (0.55) AKR1C3APEX1KDM4E
SCHEMBL691674 0.84 ERN1 (0.57) AKR1C3IAPPERN1LMNAMAPT
SCHEMBL1563517 0.84 ERN1 (0.57) AKR1C3IAPPERN1LMNAMAPT
SCHEMBL1137305 0.83 AKR1C3 (0.59) AKR1C3IAPPLMNAMAPTAPEX1
SCHEMBL208434 0.83 AKR1C3 (0.59) AKR1C3IAPPLMNAMAPTAPEX1
Phenol SCHEMBL4607887 0.79 AKR1C3 (0.53) AKR1C3LMNAMAPTAPEX1CA1
SCHEMBL8746671 0.78 AKR1C3 (0.68) AKR1C3LMNAMAPTAPEX1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0644232-B1 Free radical cured rubber GOODYEAR TIRE & RUBBER (US) 1997-03-05 EP claimed
EP-0644232-A1 Free radical cured rubber THE GOODYEAR TIRE & RUBBER COMPANY (US) 1995-03-22 EP claimed
US-5310811-A Abrasion resistance THE GOODYEAR TIRE & RUBBER COMPANY (US) 1994-05-10 US claimed
US-8080603-B2 Low hysteresis rubber elastomer MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2011-12-20 US disclosed
US-20100056686-A1 LOW HYSTERESIS RUBBER ELASTOMER SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2010-03-04 US disclosed
US-20100012241-A1 CUSHION GUM MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2010-01-21 US disclosed
EP-2114696-A1 LOW HYSTERESIS RUBBER ELASTOMER Societe de Technologie Michelin (FR) 2009-11-11 EP disclosed
WO-2008079726-A1 CUSHION GUM SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2008-07-03 WO disclosed
WO-2008079107-A1 LOW HYSTERESIS RUBBER ELASTOMER SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2008-07-03 WO disclosed
EP-0644232-B1 Free radical cured rubber GOODYEAR TIRE & RUBBER (US) 1997-03-05 EP disclosed
EP-0644232-A1 Free radical cured rubber THE GOODYEAR TIRE & RUBBER COMPANY (US) 1995-03-22 EP disclosed
US-5310811-A Abrasion resistance THE GOODYEAR TIRE & RUBBER COMPANY (US) 1994-05-10 US disclosed