SCHEMBL584872

SCHEMBL584872

CCCCCCCCCCCOc1ccc(-c2c3nc(c(-c4ccc(OCCCCCCCCCCC)cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NR5A1 Q13285 1/20 0.57
▸ LTA4H P09960 3/20 0.51
▸ TERT O14746 3/20 0.44
▸ TOP1 P11387 3/20 0.44
▸ GPR84 Q9NQS5 1/20 0.43
▸ RARB P10826 3/20 0.43
▸ CYCS P99999 2/20 0.43
▸ ABCG2 Q9UNQ0 1/20 0.43
▸ ENPP2 Q13822 1/20 0.42
▸ XDH P47989 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
SCHEMBL584947 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL584866 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL585830 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL585439 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL585897 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL586280 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL585100 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL584873 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL584741 1.00 NR5A1 (0.57) NR5A1LTA4HTERTTOP1GPR84
SCHEMBL8031578 0.94 TERT (0.49) NR5A1TERTTOP1RARBCYCS

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
EP-1768666-B1 NOVEL USES OF PORPHYRIN COMPOUNDS DESTINY PHARMA LTD (GB) 2012-02-15 — — EP disclosed
US-8084602-B2 Porphyrin derivatives and their use in photodynamic therapy DESTINY PHARMA LIMITED (CH) 2011-12-27 — — US disclosed
US-7977474-B2 Uses of porphyrin compounds DESTINY PHARMA LTD. (GB) 2011-07-12 — — US disclosed
EP-1897883-A2 Cationic porphyrin derivatives as antibacterial agents Destiny Pharma Limited (GB) 2008-03-12 — — EP disclosed
US-20070281915-A1 Porphyrin Derivatives and Their Use in Photodynamic Therapy DESTINY PHARMA LIMITED 2007-12-06 — — US disclosed
EP-1578750-B1 CATIONIC PORPHYRIN DERIVATIVES AS ANTIBACTERIAL AGENTS DESTINY PHARMA LTD (GB) 2007-11-21 — — EP disclosed
US-20070167619-A1 Novel uses of porphyrin compounds DESTINY PHARMA LTD. (GB) 2007-07-19 — — US disclosed
US-7244841-B2 Porphyrin derivatives and their use in photodynamic therapy DESTINY PHARMA LIMITED (GB) 2007-07-17 — — US disclosed
EP-1768666-A1 NOVEL USES OF PORPHYRIN COMPOUNDS Destiny Pharma Limited (GB) 2007-04-04 — — EP disclosed
WO-2006000765-A1 NOVEL USES DESTINY PHARMA LIMITED (GB) 2006-01-05 — — WO disclosed
US-20040143001-A1 Novel compounds and uses thereof DESTINY PHARMA LIMITED 2004-07-22 — — US 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 (3 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-20070167619-A1 Novel uses of porphyrin compounds PPOX, ZFX, ZYX NR5A1 2010/4885LTA4H 3552/4885TERT 732/4885
US-20040143001-A1 Novel compounds and uses thereof PPOX, CYP19A1, XDH NR5A1 271/4885LTA4H 795/4885TERT 2368/4885
US-20070281915-A1 Porphyrin Derivatives and Their Use in Photodynamic Therapy PPOX, PPIF, TYR NR5A1 1247/4885LTA4H 1756/4885TERT 2287/4885

“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.

Send feedback