SCHEMBL5809338

SCHEMBL5809338

Oc1cc2c(cc1O)C1(CC2)CCc2cc(O)c(O)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
RECQL P46063 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41
BLM P54132 1/20 0.41
CASP7 P55210 1/20 0.41
ADCY6 O43306 1/20 0.39
ADCY3 O60266 1/20 0.39
ADCY9 O60503 1/20 0.39
ADCY5 O95622 1/20 0.39
ADCY8 P40145 1/20 0.39
ADCY7 P51828 1/20 0.39
ADCY2 Q08462 1/20 0.39

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
SCHEMBL15984628 0.81 ALDH1A1 (0.40) MAPTALDH1A1KDM4ERECQLTDP1
SCHEMBL14515027 0.78 PARP1 (0.44) ALDH1A1HSD17B10
SCHEMBL22477463 0.77 ALDH1A1 (0.46) MAPTALDH1A1KDM4ERECQLTDP1
SCHEMBL218608 0.74 ALDH1A1 (0.44) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL29646235 0.74 ALDH1A1 (0.44) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL29646238 0.74 ALDH1A1 (0.44) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL215429 0.73 ESR2 (0.53) ESR1ESR2DRD2DRD1
SCHEMBL29646250 0.73 ESR2 (0.53) ESR1ESR2DRD2DRD1
SCHEMBL21730005 0.70 RXRA (0.44) MAPTALDH1A1KDM4ERECQLTDP1
SCHEMBL18327688 0.70 PBRM1 (0.37) MAPTALDH1A1KDM4ERECQLTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0599369-B1 Thermosensitive recording material AGFA GEVAERT NV (BE) 1997-02-19 EP claimed
EP-0599369-A1 Thermosensitive recording material AGFA-GEVAERT N.V. (BE) 1994-06-01 EP claimed
JP-2286641-A None JP disclosed
JP-2286641-A None JP disclosed
JP-2286642-A None JP disclosed
WO-2016161367-A1 POLYMERIC MATERIALS FOR ELECTROCHEMICAL CELLS AND ION SEPARATION PROCESSES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-10-06 WO disclosed
WO-2006081658-A1 IN SILICO SCREENING FOR SHBG BINDING LIGANDS VIA PHARMACOPHORE MODELS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2006-08-10 WO disclosed
EP-0599369-B1 Thermosensitive recording material AGFA GEVAERT NV (BE) 1997-02-19 EP disclosed
EP-0599369-A1 Thermosensitive recording material AGFA-GEVAERT N.V. (BE) 1994-06-01 EP disclosed
US-5278014-A Charge transport layer comprising a polysilane and at least one degradation inhibitor KONICA CORPORATION (JP) 1994-01-11 US disclosed
JP-H02286641-A SYNTHESIS OF 5,6,5',6'-TETRAHYDROXY-1,1'-SPIROBISINDANE FUJI PHOTO FILM CO LTD 1990-11-26 JP disclosed
JP-H02286641-A SYNTHESIS OF 5,6,5',6'-TETRAHYDROXY-1,1'-SPIROBISINDANE FUJI PHOTO FILM CO LTD 1990-11-26 JP disclosed
JP-H02286642-A SYNTHESIS OF 5,6,5',6'-TETRAHYDROXY-1,1'-SPIROBISINDANES FUJI PHOTO FILM CO LTD 1990-11-26 JP disclosed
US-4895793-A 1,1'SPIROBISINDANE COMPOUNDS AS DYE STABILIZERS; ANTISOILANTS FUJI PHOTO FILM CO., LTD. (JP) 1990-01-23 US disclosed
US-4416978-A TETRAHYDROXY SPIROBISINDANE, MAGENTA POLYMER COUPLER LATEX FUJI PHOTO FILM CO., LTD. (JP) 1983-11-22 US disclosed
US-4385111-A CONTAINING A 4-(2-ALKOXYARYLTHIO)-5-PYR-ZOLONE MAGENTA COUPLER AND SPIROBIINDENE MULTI-ETHER, ESTER, SULFONATE OR CARBAMATE AS STABILIZLERE FUJI PHOTO FILM CO., LTD. (JP) 1983-05-24 US disclosed
US-4360589-A TETRAALKOXYTETRAALKYL-1,1*-SPIROBISINDANE FUJI PHOTO FILM CO., LTD. (JP) 1982-11-23 US disclosed