SCHEMBL5408076

SCHEMBL5408076

CC(=Cc1cccc2cccnc12)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.49
▸ KDM4E B2RXH2 7/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ BACE1 P56817 1/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 8/20 0.43
▸ RECQL P46063 1/20 0.43
▸ LMNA P02545 3/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ HPGD P15428 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ METAP2 P50579 2/20 0.43
▸ METAP1 P53582 2/20 0.43
▸ MMP2 P08253 1/20 0.43

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
SCHEMBL5501143 1.00 PARP1 (0.49) PARP1KDM4ENPC1GAARAB9A
SCHEMBL11760938 0.85 KDM4E (0.45) PARP1KDM4ENPC1GAARAB9A
SCHEMBL11760944 0.85 KDM4E (0.45) PARP1KDM4ENPC1GAARAB9A
SCHEMBL16307963 0.82 MMP2 (0.50) PARP1KDM4ENPC1GAARAB9A
SCHEMBL4559518 0.78 NAPRT (0.47) AKR1C3
SCHEMBL4559515 0.78 NAPRT (0.47) AKR1C3
SCHEMBL8746672 0.76 AKR1C3 (0.52) KDM4ENPC1KMT2AALDH1A1CYP1A2
SCHEMBL3537147 0.74 BACE1 (0.60) PARP1KDM4ENPC1GAARAB9A
SCHEMBL3537145 0.74 BACE1 (0.60) PARP1KDM4ENPC1GAARAB9A
Phenanthroline SCHEMBL22401704 0.74 LMNA (0.70) PARP1KDM4EALDH1A1LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0069559-B1 MARINE PAINT INTERNATIONAL PAINT Public Limited Company (GB) 1985-05-02 — — EP claimed
US-7291361-B2 Image forming process, image-recorded article, liquid composition and ink-jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2007-11-06 — — US disclosed
EP-1744322-A1 Devices containing multi-bit data Rohm and Haas Electronic Materials, L.L.C. (US) 2007-01-17 — — EP disclosed
US-20070009821-A1 Devices containing multi-bit data CUTLER CHARLOTTE 2007-01-11 — — US disclosed
US-20050007436-A1 Image forming process, image-recorded article, liquid composition and ink-jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2005-01-13 — — US disclosed
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