SCHEMBL6771823

SCHEMBL6771823

CCOC(=O)CC(CS(=O)(=O)c1cccc(O)c1)c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.39
F2 P00734 4/20 0.39
KMT2A Q03164 4/20 0.39
GAA P10253 1/20 0.38
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
BID P55957 1/20 0.37
BCL2A1 Q16548 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TLR9 Q9NR96 1/20 0.37
PHGDH O43175 1/20 0.37
PRSS1 P07477 1/20 0.35
MMP1 P03956 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
SCHEMBL6774874 0.90 F10 (0.43) F10F2KMT2AGAAALDH1A1
SCHEMBL6769646 0.87 KMT2A (0.44) F10F2KMT2AGAALMNA
SCHEMBL7566284 0.74 F2 (0.48) F10F2KMT2AGAALMNA
SCHEMBL6772429 0.73 KMT2A (0.47) KMT2AGAALMNANPSR1HPGD
SCHEMBL7566821 0.72 F2 (0.52) F10F2KMT2AGAALMNA
SCHEMBL7074900 0.71 F2 (0.45) F10F2KMT2AGAALMNA
SCHEMBL7079059 0.71 ALDH1A1 (0.45) KMT2ALMNANPSR1ALDH1A1HTT
SCHEMBL5661841 0.71 F10 (0.48) F10F2LMNAALDH1A1PRSS1
SCHEMBL3517765 0.69 HPGD (0.50) KMT2AGAALMNANPSR1KDM4E
SCHEMBL13318277 0.69 HPGD (0.50) KMT2AGAALMNANPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833366-B1 Dihydrostilbene alkanoic acid derivatives PHARMACIA CORPORATION 2004-12-21 US disclosed
US-6720315-B2 FOR INHIBITING BONE RESORPTION, PERIODONTAL DISEASE, OSTEOPOROSIS, HUMORAL HYPERCALCEMIA OF MALIGNANCY, PAGET'S DISEASE, TUMOR METASTASIS, SOLID TUMOR GROWTH, ANGIOGENESIS, MACULAR DEGENERATION AND DIABETIC RETINOPATHY RETINOPATHY PHARMACIA CORPORATION 2004-04-13 US disclosed
EP-1289959-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS Pharmacia Corporation (US) 2003-03-12 EP disclosed
WO-2001096310-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO disclosed