SCHEMBL6665065

SCHEMBL6665065

NCCc1ncc2ccccc2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.41
KDM4E B2RXH2 1/20 0.39
GPR3 P46089 1/20 0.39
EGFR P00533 1/20 0.39
PDE10A Q9Y233 3/20 0.38
HRH1 P35367 1/20 0.38
CYP1A2 P05177 2/20 0.38
ALDH1A1 P00352 2/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
ACHE P22303 1/20 0.37
HTR3A P46098 2/20 0.37
HRH4 Q9H3N8 1/20 0.37
NCF1 P14598 1/20 0.36
NOS2 P35228 1/20 0.36
BACE1 P56817 1/20 0.36
CYP2A6 P11509 1/20 0.35
HTR2A P28223 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL28605200 0.87 HRH1 (0.42) KDM4EGPR3EGFRPDE10AHRH1
SCHEMBL2263641 0.84 KDM4E (0.42) LOXL2KDM4EGPR3EGFRPDE10A
SCHEMBL5741619 0.81 KDM4E (0.39) KDM4EGPR3EGFRPDE10ACYP1A2
SCHEMBL9971271 0.81 KDM4E (0.44) KDM4EGPR3EGFRPDE10ACYP1A2
SCHEMBL30553021 0.81 KDM4E (0.39) KDM4EGPR3EGFRPDE10ACYP1A2
SCHEMBL30918003 0.79 HTR2C (0.49) KDM4EGPR3EGFRSMN1; SMN2NPC1
SCHEMBL7546075 0.79 KDM4E (0.38) KDM4EGPR3EGFRPDE10ACYP1A2
SCHEMBL27374635 0.79 HTR2C (0.49) KDM4EGPR3EGFRSMN1; SMN2NPC1
SCHEMBL7069013 0.78 TLR8 (0.49) KDM4EALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL7548524 0.78 KDM4E (0.37) KDM4EGPR3EGFRPDE10ACYP1A2

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-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2004009869-A2 CORROSION-INHIBITING COATING FOR METAL SURFACES UNIVERSITY OF DAYTON (US) 2004-01-29 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed