SCHEMBL5792178

SCHEMBL5792178

NNNc1ccccc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.43
MAPT P10636 4/20 0.43
KDM4E B2RXH2 3/20 0.43
CA2 P00918 3/20 0.43
RAB9A P51151 3/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CA12 O43570 2/20 0.43
ALOX15 P16050 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MMP9 P14780 2/20 0.43
RECQL P46063 2/20 0.43
GMNN O75496 1/20 0.43
EGFR P00533 1/20 0.43
FYN P06241 1/20 0.43
POLB P06746 1/20 0.43
CA3 P07451 1/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
NFKB1 P19838 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
SCHEMBL11648181 0.84 NPC1 (0.53) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL364068 0.79
SCHEMBL7811923 0.75 MAPT (0.43) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL22169178 0.73 ALDH1A1 (0.57) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL9179113 0.73 KDM1A (0.46) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL10942883 0.73 CA1 (0.61) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL304891 0.73 CXCR2 (0.54) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL28421037 0.72 MAPT (0.50) NPC1MAPTKDM4ERAB9ALMNA
SCHEMBL5570988 0.71 MAPT (0.42) NPC1MAPTKDM4ECA2RAB9A
SCHEMBL1920752 0.70 CXCR2 (0.52) NPC1MAPTKDM4ECA2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006036520-A1 BIOFRIENDLY CORROSION-INHIBITING LAYER DEPOSITED FROM FUGITIVE BIODEGRADABLE SOLVENT AND FILM-FORMING OIL NORTHERN TECHNOLOGIES INTERNATIONAL CORPORATION (US) 2006-04-06 WO claimed
US-20060062994-A1 Biofriendly corrosion-inhibiting layer deposited from fugitive biodegradable solvent and film-forming oil NORTHERN TECHNOLOGIES INTERNATIONAL CORPORATION 2006-03-23 US claimed
US-3953344-A THERMOPLASTIC RESIN, GROUP 2A METAL SOAP, CORROSION INHIBITOR NIPPON PAINT CO., LTD. (JA) 1976-04-27 US claimed
WO-2006036520-A1 BIOFRIENDLY CORROSION-INHIBITING LAYER DEPOSITED FROM FUGITIVE BIODEGRADABLE SOLVENT AND FILM-FORMING OIL NORTHERN TECHNOLOGIES INTERNATIONAL CORPORATION (US) 2006-04-06 WO disclosed
US-20060062994-A1 Biofriendly corrosion-inhibiting layer deposited from fugitive biodegradable solvent and film-forming oil NORTHERN TECHNOLOGIES INTERNATIONAL CORPORATION 2006-03-23 US disclosed
US-4016087-A Surface treating agent for processing of metals NIPPON PAINT CO., LTD. (JA) 1977-04-05 US disclosed
US-3953344-A THERMOPLASTIC RESIN, GROUP 2A METAL SOAP, CORROSION INHIBITOR NIPPON PAINT CO., LTD. (JA) 1976-04-27 US disclosed