SCHEMBL2943913

SCHEMBL2943913

CC(C)(C)OC(=O)N(c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1)S(N)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.50
▸ HTT P42858 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ RORC P51449 3/20 0.46
▸ NR1H3 Q13133 10/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NR1H2 P55055 5/20 0.44
▸ MLYCD O95822 5/20 0.44
▸ NR1I2 O75469 1/20 0.41
▸ RORA P35398 1/20 0.41
▸ RORB Q92753 1/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41

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
SCHEMBL22638579 0.78 CA2 (0.41) SMN1; SMN2
SCHEMBL11411032 0.72 LMNA (0.69) LMNAHTTNPSR1SMN1; SMN2RORC
SCHEMBL4918537 0.69 TP53 (0.50) LMNASMN1; SMN2
SCHEMBL2968367 0.68 MMP2 (0.41) LMNA
SCHEMBL8588375 0.68 MIF (0.38) GAAMAPK1
SCHEMBL22032969 0.68 ALDH1A1 (0.44) LMNAHTTNPSR1SMN1; SMN2GAA
SCHEMBL272401 0.67 KIF11 (0.40) LMNAHTTNPSR1NR1H3NR1H2
SCHEMBL2378054 0.67 SMN1; SMN2 (0.39) LMNAHTTNPSR1SMN1; SMN2NR1H3
SCHEMBL27498638 0.67 MT-CO2 (0.48) LMNASMN1; SMN2
SCHEMBL11409285 0.67 MLYCD (0.49) LMNASMN1; SMN2RORCNR1H3NR1H2

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
JP-4503232-B2 — — 2010-07-14 — — JP claimed
JP-2004521113-A — — 2004-07-15 — — JP claimed
EP-1353662-A2 METHODS FOR THE TREATMENT OF DISEASES USING MALONYL-COA DECARBOX YLASE INHIBITORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-10-22 — — EP claimed
WO-2002058690-A2 METHODS FOR THE TREATMENT OF DISEASES USING MALONYL-COA DECARBOX YLASE INHIBITORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-08-01 — — WO claimed
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