SCHEMBL9506969

SCHEMBL9506969

CCCCCCCCCCCCCCC=Cc1ccc(C(=O)N(C)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.49
ALDH1A1 P00352 2/20 0.39
DUSP3 P51452 1/20 0.39
PTPN7 P35236 1/20 0.39
KDM4E B2RXH2 1/20 0.39
FFAR1 O14842 1/20 0.39
LMNA P02545 1/20 0.39
FABP3 P05413 1/20 0.39
CYP3A4 P08684 1/20 0.39
F7 P08709 1/20 0.39
CYP19A1 P11511 1/20 0.39
F3 P13726 1/20 0.39
FABP4 P15090 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
PTGS1 P23219 1/20 0.39
GNA15 P30679 1/20 0.39
PPARG P37231 1/20 0.39
AKR1C3 P42330 1/20 0.39

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
SCHEMBL9506962 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9506075 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9508951 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9508296 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9506896 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9506886 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9508944 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9506072 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9508304 1.00 TNNC1 (0.49) TNNC1ALDH1A1DUSP3PTPN7KDM4E
SCHEMBL9506877 0.94 TNNC1 (0.42) TNNC1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed
CN-85104470-A The method for preparing arythydroxamtes 1986-10-01 CN disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP disclosed