SCHEMBL8203697

SCHEMBL8203697

COCCc1c(C(=O)OC)[nH]c(C)c1C(=O)OC

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.59
MAPK1 P28482 1/20 0.59
NPSR1 Q6W5P4 2/20 0.50
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 4/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
TSHR P16473 2/20 0.43
LMNA P02545 4/20 0.42
POLB P06746 2/20 0.40
NR4A2 P43354 1/20 0.40
HTT P42858 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL1126546 0.84 HPGD (0.64) HPGDMAPK1RAB9ANPC1L3MBTL1
SCHEMBL8202821 0.83 LMNA (0.44) HPGDMAPK1NPSR1RAB9ANPC1
SCHEMBL15151364 0.78 MAPK1 (0.45) HPGDMAPK1RAB9ANPC1L3MBTL1
SCHEMBL22137307 0.74 MAPK1 (0.52) HPGDMAPK1NPSR1RAB9ANPC1
SCHEMBL7256405 0.73 NPSR1 (0.79) HPGDMAPK1NPSR1RAB9ANPC1
SCHEMBL26088689 0.73 MAPK1 (0.61) HPGDMAPK1RAB9ANPC1L3MBTL1
SCHEMBL10618518 0.71 MAPK1 (0.75) HPGDMAPK1RAB9ANPC1L3MBTL1
SCHEMBL17520292 0.70 NPSR1 (0.49) HPGDMAPK1NPSR1RAB9ANPC1
SCHEMBL26422717 0.69 NPSR1 (0.59) HPGDMAPK1NPSR1RAB9ANPC1
SCHEMBL15151658 0.68 RAB9A (0.49) HPGDMAPK1NPSR1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0591355-B1 PORPHYCENE COMPOUNDS FOR PHOTODYNAMIC THERAPY CYTOPHARM INC (US) 2000-03-08 EP disclosed
EP-0591355-A4 PORPHYCENE COMPOUNDS FOR PHOTODYNAMIC THERAPY. CYTOPHARM INC (US) 1995-01-18 EP disclosed
EP-0591355-A1 PORPHYCENE COMPOUNDS FOR PHOTODYNAMIC THERAPY CYTOPHARM, INC. (US) 1994-04-13 EP disclosed
US-5262401-A Porphyrins as antitumor agents and psoriasis treatment CYTOPHARM, INC. (US) 1993-11-16 US disclosed
US-5179120-A Antitumor agents or psoriasis CYTOPHARM, INC. (US) 1993-01-12 US disclosed
WO-1993000087-A1 PORPHYCENE COMPOUNDS FOR PHOTODYNAMIC THERAPY CYTOPHARM, INC. (US) 1993-01-07 WO disclosed