SCHEMBL14219680

SCHEMBL14219680

Cc1cc(I)cnc1Nc1c(C(=O)O)ccc(F)c1F

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 10/20 0.55
MAP2K2 P36507 8/20 0.55
DHODH Q02127 7/20 0.42
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
PIM1 P11309 1/20 0.37
CAMK2B Q13554 1/20 0.37
IDO1 P14902 1/20 0.36

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
SCHEMBL14222838 0.88 MAP2K1 (0.57) MAP2K1MAP2K2DHODHPIM1CAMK2B
SCHEMBL14219621 0.88 MAP2K1 (0.48) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL14219608 0.86 DHODH (0.54) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL14220096 0.86 MEN1 (0.40) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL14219679 0.85 MAP2K1 (0.46) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL14219682 0.82 MAP2K1 (0.44) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL14219676 0.82 MAP2K1 (0.40) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL14219688 0.82 LMNA (0.36) MAP2K1MAP2K2DHODHLMNAGAA
SCHEMBL29425477 0.79 MAP2K1 (0.78) MAP2K1MAP2K2PIM1CAMK2BIDO1
SCHEMBL4851710 0.79 MAP2K1 (0.78) MAP2K1MAP2K2PIM1CAMK2BIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008041088-A2 N-HYDROXY BENZAMIDES WITH ANTITUMOR ACTIVITY EOS (ETHICAL ONCOLOGY SCIENCE) S.P.A. (IT) 2008-04-10 WO disclosed
EP-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed