SCHEMBL16247124

SCHEMBL16247124

CC(=O)OCc1cccc(-c2c3nc(c(-c4cccc(COC(C)=O)c4)c4ccc([nH]4)c(-c4cccc(COC(C)=O)c4)c4nc(c(-c5cccc(COC(C)=O)c5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.45
▸ CYCS P99999 4/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ TERT O14746 4/20 0.41
▸ ENPP2 Q13822 1/20 0.40
▸ MMP1 P03956 2/20 0.39
▸ MMP2 P08253 2/20 0.39
▸ MMP12 P39900 2/20 0.39
▸ PRKDC P78527 1/20 0.39
▸ MMP9 P14780 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
SCHEMBL4260949 0.81 TOP1 (0.45) TOP1CYCSABCG2TERTENPP2
SCHEMBL8907738 0.81 ABCG2 (0.49) TOP1CYCSABCG2TERTENPP2
SCHEMBL4261959 0.80 TOP1 (0.44) TOP1CYCSABCG2TERTENPP2
SCHEMBL4266260 0.80 TOP1 (0.44) TOP1CYCSABCG2TERTENPP2
SCHEMBL8865842 0.79 PDE3B (0.48) TOP1CYCSABCG2ALDH1A1
SCHEMBL8909228 0.79 GRIN2D (0.53) TOP1CYCSABCG2ALDH1A1TERT
SCHEMBL8908306 0.79 TOP1 (0.48) TOP1CYCSABCG2TERTENPP2
Hydrochloric Acid SCHEMBL8865260 0.78 TOP1 (0.47) TOP1CYCSABCG2TERTENPP2
SCHEMBL8908003 0.77 FFAR1 (0.51) TOP1CYCS
SCHEMBL4268731 0.76 TERT (0.46) TOP1CYCSTERTENPP2

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
EP-2996677-B1 PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY UNIV NAT CHUNG HSING (TW) 2019-11-20 — — EP disclosed
US-20160082127-A1 PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY NATIONAL CHUNG HSING UNIVERSITY (TW) 2016-03-24 — — US disclosed
EP-2996677-A1 PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY DCB-USA LLC (US) 2016-03-23 — — EP disclosed
WO-2014189796-A1 PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY DCB-USA LLC (US) 2014-11-27 — — WO disclosed
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