SCHEMBL9079609

SCHEMBL9079609

CC(=O)NN=C(c1ccc(Cl)cc1)c1ccc(OS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ENPP1 P22413 5/20 0.41
ENPP3 O14638 4/20 0.41
ENPP2 Q13822 3/20 0.41
CXCR2 P25025 2/20 0.41
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL10973313 1.00 MEN1 (0.42) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL11032656 0.89 MEN1 (0.41) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL11032658 0.89 MEN1 (0.41) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL7104414 0.88 ENPP1 (0.41) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL7104412 0.88 ENPP1 (0.41) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL9173410 0.87 ALDH1A1 (0.39) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL8539695 0.86 ENPP1 (0.41) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL8535057 0.85 ALDH1A1 (0.53) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL9079636 0.85 SMN1; SMN2 (0.44) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL11033152 0.85 ALDH1A1 (0.46) MEN1KMT2AENPP1ENPP3ENPP2

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
EP-0026040-B1 SUBSTITUTED BENZOPHENONE HYDRAZONES, PESTICIDAL COMPOSITIONS CONTAINING THEM AND METHOD OF COMBATING PESTS FBC LIMITED (GB) 1985-03-13 EP claimed
US-5563174-A LOW TOXICITY TO MAMMALS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-08 US disclosed