SCHEMBL6771000

SCHEMBL6771000

CC(CC(=O)O)NS(=O)(=O)c1cccc(O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
MMP13 P45452 1/20 0.43
ITGB3 P05106 1/20 0.43
ITGAV P06756 1/20 0.43
EEF2K O00418 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
KAT7 O95251 1/20 0.40
KAT6A Q92794 1/20 0.40
CTSL P07711 2/20 0.40
CTSS P25774 2/20 0.40
CTSK P43235 2/20 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
SCHEMBL7660712 0.85 SMN1; SMN2 (0.63) ADAMTS4SMN1; SMN2ALDH1A1CYP1A2CYP2C9
SCHEMBL6774257 0.82 MEP1B (0.57) ADAMTS4ALDH1A1ITGAVL3MBTL1HDAC8
SCHEMBL5183280 0.81 NPSR1 (0.67) ADAMTS4ALDH1A1CYP2C9CYP2C19NPSR1
SCHEMBL5184471 0.81 NPSR1 (0.67) ADAMTS4ALDH1A1CYP2C9CYP2C19NPSR1
SCHEMBL6772863 0.81 EEF2K (0.66) ALDH1A1ITGB3ITGAVEEF2KL3MBTL1
SCHEMBL9866942 0.80 HTR2B (0.49) ADAMTS4ALDH1A1NPSR1
SCHEMBL6773446 0.78 ADAMTS4 (0.39) ADAMTS4ALDH1A1MMP13ITGB3ITGAV
SCHEMBL6771004 0.77 ADAMTS4 (0.51) ADAMTS4MMP13L3MBTL1
SCHEMBL5184849 0.77 RAB9A (0.56) ADAMTS4ALDH1A1NPSR1EEF2KL3MBTL1
SCHEMBL6771881 0.76 ITGB3 (0.48) ALDH1A1ITGB3ITGAVKAT6A

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 5 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
US-20020099209-A1 Dihydrostilbene alkanoic acid derivatives PHARMACIA CORPORATION 2002-07-25 US disclosed
WO-2001096310-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020099209-A1 Dihydrostilbene alkanoic acid derivatives ITGA5, ITGB5, ITGB1 ADAMTS4 1966/4885SMN1; SMN2 2300/4885ALDH1A1 94/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.