SCHEMBL7366039

SCHEMBL7366039

COc1ccc(CNC(=O)c2cc(C#N)ccc2F)cc1F

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
HPGD P15428 1/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PDE10A Q9Y233 2/20 0.48
MAOB P27338 1/20 0.48
CHRM4 P08173 2/20 0.47
AKR1B1 P15121 1/20 0.46
WDR5 P61964 1/20 0.46
APEX1 P27695 1/20 0.45

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
SCHEMBL6941632 0.93 ALDH1A1 (0.53) ALDH1A1LMNASMN1; SMN2PDE10AWDR5
SCHEMBL7366361 0.91 LMNA (0.44) ALDH1A1LMNAHPGDMAPK1HTT
SCHEMBL7362803 0.90 PDE5A (0.53) LMNAHPGDAKR1B1WDR5
SCHEMBL6941529 0.88 LMNA (0.50) LMNAHPGDPDE10AAKR1B1WDR5
SCHEMBL1585401 0.87 PDPK1 (0.50) PDE10AMAOBAKR1B1WDR5
SCHEMBL7451626 0.84 ALDH1A1 (0.46) ALDH1A1LMNAHPGDMAPK1HTT
SCHEMBL7509935 0.83 ALDH1A1 (0.44) ALDH1A1LMNAHPGDMAPK1HTT
SCHEMBL7509941 0.83 ALDH1A1 (0.44) ALDH1A1LMNAHPGDMAPK1HTT
SCHEMBL31171390 0.82 KMT2A (0.51) ALDH1A1LMNAHTTSMN1; SMN2AKR1B1
SCHEMBL6940772 0.79 ALDH1A1 (0.53) ALDH1A1LMNAHPGDMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001030745-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-03 WO disclosed