SCHEMBL6903428

SCHEMBL6903428

O=C(C1=CC=CC1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
AKR1C3 P42330 1/20 0.45
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SRD5A2 P31213 1/20 0.43
CYP2C8 P10632 1/20 0.43
CYP2C9 P11712 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 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
SCHEMBL19865171 0.92 ALDH1A1 (0.46) ALDH1A1AKR1C3ATMTDP1L3MBTL1
SCHEMBL17236567 0.82 LMNA (0.52) ALDH1A1TDP1L3MBTL1SRD5A2KDM4E
SCHEMBL4661910 0.81 ALDH1A1 (0.46) ALDH1A1AKR1C3ATMTDP1L3MBTL1
SCHEMBL7632143 0.79 CA2 (0.33) ALDH1A1AKR1C3ATMMAPTCA2
SCHEMBL17236569 0.78 MAPT (0.51) ALDH1A1GAAMAPTNPC1HPGD
Benzophenone SCHEMBL9310484 0.77 ALDH1A1 (0.52) ALDH1A1AKR1C3ATMTDP1L3MBTL1
SCHEMBL12815384 0.76 MEN1 (0.41) ALDH1A1ATMMAPTMEN1KMT2A
SCHEMBL59663 0.76 ALDH1A1 (0.45) ALDH1A1AKR1C3ATMTDP1L3MBTL1
SCHEMBL3211578 0.75 AKR1C3 (0.46) ALDH1A1AKR1C3ATMTDP1CYP2C8
SCHEMBL7478487 0.74 ALDH1A1 (0.43) ALDH1A1AKR1C3ATMTDP1L3MBTL1

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 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1114057-B1 PROCESS FOR PREPARING CYCLOPENTADIENYLIRON (II) ARENE COMPLEX MINNESOTA MINING & MFG (US) 2003-04-09 EP claimed
EP-1114057-A1 PROCESS FOR PREPARING CYCLOPENTADIENYLIRON (II) ARENE COMPLEX MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2001-07-11 EP claimed
US-6255507-B1 BY PROVIDING MIXTURE OF REACTANTS COMPRISING FERROCENE, ARENE, LEWIS ACID, AND FERRIC ION; IN SITU CONVERSION, REDUCTION OF FERRIC TO FERROUS ION; USED FOR LIGHT-ACTIVATED THERMAL CATALYSTS OF POLYMERIZATION REACTIONS 3M INNOVATIVE PROPERTIES COMPANY 2001-07-03 US claimed
WO-2000017214-A1 PROCESS FOR PREPARING CYCLOPENTADIENYLIRON (II) ARENE COMPLEX MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-03-30 WO claimed
EP-0621963-B1 VISIBLE AND ULTRAVIOLET IRRADIATION PHOTOSENSITIVE SYSTEM FOR FILM-FORMING PIGMENTED PHOTO-CROSSLINKABLE COMPOSITIONS CELLIOSE (FR) 1999-09-22 EP claimed
EP-0621963-A1 VISIBLE AND ULTRAVIOLET IRRADIATION PHOTOSENSITIVE SYSTEM FOR FILM-FORMING PIGMENTED PHOTO-CROSSLINKABLE COMPOSITIONS CELLIOSE (FR) 1994-11-02 EP claimed
WO-1993015440-A1 VISIBLE AND ULTRAVIOLET IRRADIATION PHOTOSENSITIVE SYSTEM FOR FILM-FORMING PIGMENTED PHOTO-CROSSLINKABLE COMPOSITIONS CELLIOSE (FR) 1993-08-05 WO claimed
EP-0325617-A1 THIOLENE COMPOSITIONS BASED ON BICYCLIC 'ENE COMPOUNDS. LOCTITE CORP (US) 1989-08-02 EP claimed
US-4808638-A CROSSLINKING WITH POLYMERCAPTANS LOCTITE CORPORATION (US) 1989-02-28 US claimed
WO-1988002902-A2 THIOLENE COMPOSITIONS BASED ON BICYCLIC 'ENE COMPOUNDS LOCTITE CORPORATION (US) 1988-04-21 WO claimed
US-20110019265-A1 DISPLAY ELEMENT AND METHOD OF FORMING POROUS LAYER IN DISPLAY ELEMENT KONICA MINOLTA HOLDINGS, INC. (JP) 2011-01-27 US disclosed
US-20090303855-A1 TWO-PHOTON-ABSORBING RECORDING MEDIUM, TWO-PHOTON-ABSORBING RECORDING/REPRODUCING METHOD, AND TWO-PHOTON-ABSORBING RECORDING/REPRODUCING APPARATUS FUJIFILM CORPORATION (JP) 2009-12-10 US disclosed
US-6747077-B2 HINDERED AMINE CIBA SPECIALTY CHEMICALS CORPORATION 2004-06-08 US disclosed
EP-1114057-B1 PROCESS FOR PREPARING CYCLOPENTADIENYLIRON (II) ARENE COMPLEX MINNESOTA MINING & MFG (US) 2003-04-09 EP disclosed
US-6512029-B1 Stabilized metallocene polyolefins CIBA SPECIALTY CHEMICALS CORPORATION 2003-01-28 US disclosed
EP-0153904-A2 Process for the preparation of a protection layer or a relief pattern CIBA-GEIGY AG (CH) 1985-09-04 EP disclosed
EP-0126712-A1 Curable composition and use thereof CIBA-GEIGY AG (CH) 1984-11-28 EP disclosed
EP-0094915-A2 Curable compositions containing metallocen complexes, activated primers obtained therefrom and their use CIBA-GEIGY AG (CH) 1983-11-23 EP disclosed
US-4317943-A USING A CATALYST CONTAINING A COBALT COMPOUND AND A CYCLOPENTADIENE LIGAND TO REACT AN ALDEHYDE, ALCOHOL, AND SYNTHESIS GAS TEXACO INC. (US) 1982-03-02 US disclosed
US-4127497-A Michael adducts of (substituted) cyclopentadiene and esters: a process therefor and derivatives thereof THE DOW CHEMICAL COMPANY (US) 1978-11-28 US disclosed