SCHEMBL8438515

SCHEMBL8438515

CCOc1ccc(NC(=O)c2ccc(O)cc2O)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 2/20 0.73
NPC1 O15118 8/20 0.71
RAB9A P51151 7/20 0.71
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
TP53 P04637 4/20 0.71
SMN1; SMN2 Q16637 3/20 0.71
HTT P42858 2/20 0.71
LMNA P02545 2/20 0.71
KDM4E B2RXH2 2/20 0.71
POLB P06746 3/20 0.70
MAPT P10636 2/20 0.70
MAPK1 P28482 2/20 0.70
APOBEC3A P31941 1/20 0.70
APOBEC3G Q9HC16 1/20 0.70
PLAU P00749 2/20 0.70
F2 P00734 1/20 0.70
F10 P00742 1/20 0.70
PLAT P00750 1/20 0.70
TAS1R3 Q7RTX0 1/20 0.59

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
SCHEMBL2272830 0.84 KLKB1 (0.69) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL28950493 0.84 KLKB1 (0.56) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL27347841 0.83 RAB9A (1.00) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL30307513 0.83 RAB9A (1.00) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL2743100 0.82 NPC1 (1.00) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL29616891 0.82 NPC1 (1.00) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL2270561 0.82 LMNA (0.68) KLKB1MEN1KMT2ATP53HTT
SCHEMBL8439279 0.82 PNLIP (0.65) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL11315728 0.81 KLKB1 (0.64) KLKB1NPC1RAB9AMEN1KMT2A
SCHEMBL10880536 0.80 NPC1 (0.78) NPC1RAB9AMEN1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0756943-B1 Heat sensitive recording material NEW OJI PAPER CO LTD (JP) 1999-12-22 EP disclosed
US-5753588-A COMPRISING INDOLYLDIAZAPHTHALIDE BASIC DYE, DIPHENYL SULFONE OR BENZANILIDE DERIVATIVE COLOR ACCEPTOR NEW OJI PAPER COMPANY LIMITED (JP) 1998-05-19 US disclosed
EP-0756943-A1 Heat sensitive recording material NEW OJI PAPER CO., LTD. (JP) 1997-02-05 EP disclosed