SCHEMBL8204175

SCHEMBL8204175

O=C(O)CCN(C1CCCCC1)C1CCCCC1.[Zn]

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KDM5A P29375 4/20 0.42
PHF8 Q9UPP1 4/20 0.42
KDM2A Q9Y2K7 4/20 0.42
KDM4C Q9H3R0 3/20 0.42
KDM4A O75164 1/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
EPHX2 P34913 1/20 0.40
LMNA P02545 1/20 0.39
EPHX1 P07099 1/20 0.38
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM7A Q6ZMT4 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL9069176 0.98 ALDH1A1 (0.47) ALDH1A1KDM5APHF8KDM2AKDM4C
SCHEMBL11584425 0.96 ALDH1A1 (0.46) ALDH1A1KDM5APHF8KDM2AKDM4C
SCHEMBL28657065 0.83 ALDH1A1 (0.41) ALDH1A1KDM5APHF8KDM2AKDM4C
SCHEMBL11433485 0.81 ALDH1A1 (0.47) ALDH1A1KDM5APHF8KDM2AKDM4C
SCHEMBL11396586 0.81 GAA (0.43) ALDH1A1KDM5APHF8KDM2AKDM4C
SCHEMBL8377528 0.79 KMT2A (0.47) ALDH1A1THRATHRBEPHX2LMNA
SCHEMBL3188510 0.78 ALDH1A1 (0.46) ALDH1A1KDM5APHF8KDM2AKDM4C
SCHEMBL11584430 0.78 THRA (0.40) ALDH1A1THRATHRBLMNAGAA
Zinc Ion SCHEMBL8204181 0.78 THRA (0.40) ALDH1A1THRATHRBLMNAGAA
SCHEMBL5800001 0.76 NPSR1 (0.44) ALDH1A1LMNAGAANPSR1

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
US-6127467-A CORROSION RESISTANCE PROTECTIVE COATING ON A METAL SURFACE CONSISTS OF A AMINOCARBOXYLATE SALT, A PIGMENT, A LATEX BINDER AND A SOLVENT COSAN CHEMICAL CORPORATION (US) 2000-10-03 US claimed
EP-0494956-B1 AMINOCARBOXYLATE SALTS AS CORROSION INHIBITORS IN COATING APPLICATIONS COSAN CHEM CORP (US) 1995-12-13 EP claimed
EP-0494956-A4 AMINOCARBOXYLATE SALTS AS CORROSION INHIBITORS IN COATING APPLICATIONS 1993-07-21 EP claimed
EP-0494956-A1 AMINOCARBOXYLATE SALTS AS CORROSION INHIBITORS IN COATING APPLICATIONS. COSAN CHEM CORP (US) 1992-07-22 EP claimed
WO-1991004952-A1 AMINOCARBOXYLATE SALTS AS CORROSION INHIBITORS IN COATING APPLICATIONS COSAN CHEMICAL CORPORATION (US) 1991-04-18 WO claimed
US-6127467-A CORROSION RESISTANCE PROTECTIVE COATING ON A METAL SURFACE CONSISTS OF A AMINOCARBOXYLATE SALT, A PIGMENT, A LATEX BINDER AND A SOLVENT COSAN CHEMICAL CORPORATION (US) 2000-10-03 US disclosed
EP-0494956-B1 AMINOCARBOXYLATE SALTS AS CORROSION INHIBITORS IN COATING APPLICATIONS COSAN CHEM CORP (US) 1995-12-13 EP disclosed