SCHEMBL7091361

SCHEMBL7091361

O=S(=O)(O)c1ccc(CCP(CCc2ccc(S(=O)(=O)O)cc2)CCc2ccc(S(=O)(=O)O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
TSHR P16473 3/20 0.45
ALDH1A1 P00352 1/20 0.45
NT5E P21589 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
CA2 P00918 10/20 0.42
CA1 P00915 5/20 0.42
CA12 O43570 4/20 0.42
CA9 Q16790 4/20 0.42
CA4 P22748 3/20 0.42
CA6 P23280 3/20 0.42
CA5A P35218 3/20 0.42
CA7 P43166 3/20 0.42
CA14 Q9ULX7 3/20 0.42
CA5B Q9Y2D0 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
CYP2D6 P10635 2/20 0.38
F2 P00734 2/20 0.38
TMPRSS4 Q9NRS4 2/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL6688445 0.98 LMNA (0.45) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL7088221 0.88 CA2 (0.46) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL8533059 0.86 CA2 (0.47) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL6704699 0.85 CA2 (0.46) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL11583429 0.84 LMNA (0.56) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL6704622 0.83 CA2 (0.47) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL30446884 0.80 CA2 (0.57) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL92261 0.78 CA2 (0.67) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1804175 0.78 LMNA (0.50) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL16350024 0.78 LMNA (0.50) LMNATSHRALDH1A1NT5ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030152512-A1 Imaging thrombus with glycoprotein llb/llla antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY (FORMERLY D/B/A DUPONT PHARMACEUTICALS COMPANY) 2003-08-14 US disclosed
EP-0820312-B1 TERNARY RADIOPHARMACEUTICAL COMPLEXES BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-07-10 EP disclosed
EP-1195168-A2 Ternary radiopharmaceutical complexes Dupont Pharmaceuticals Company (US) 2002-04-10 EP disclosed
US-6010679-A TRANSITION METAL RADIONUCLEOLIDE; CONTRAST AGENTS FOR DIAGNOSING CARDIOVASCULAR DISORDERS, CANCER LANTHEUS MEDICAL IMAGING, INC. 2000-01-04 US disclosed
EP-0789551-A4 HAIR CARE PERMING AGENTS AND PROCESSES LAU JOHN R (US) 1998-12-02 EP disclosed
US-5744120-A PHOSPHINE OR ARSINE LIGATED TECHNETIUM-99M LABELED HYDRAZINO OR DIAZINO MODIFIED BIOLOGICALLY ACTIVE MOLECULES THAT SELECTIVELY LOCALIZE AT SITES OF DISEASE THE DUPONT MERICK PHARMACEUTICAL COMPANY (US) 1998-04-28 US disclosed
EP-0820312-A4 TERNARY RADIOPHARMACEUTICAL COMPLEXES DU PONT MERCK PHARMA (US) 1998-03-18 EP disclosed
EP-0820312-A1 TERNARY RADIOPHARMACEUTICAL COMPLEXES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-01-28 EP disclosed
EP-0789551-A1 HAIR CARE PERMING AGENTS AND PROCESSES LAU, John R. (US) 1997-08-20 EP disclosed
WO-1997011672-A1 HAIR CARE PERMING AGENTS AND PROCESSES LAU JOHN R (US) 1997-04-03 WO disclosed
WO-1996031243-A1 TERNARY RADIOPHARMACEUTICAL COMPLEXES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-10-10 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-20030152512-A1 Imaging thrombus with glycoprotein llb/llla antagonists FGB, SELPLG, SELL LMNA 1619/4885TSHR 279/4885ALDH1A1 3580/4885

“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.