SCHEMBL5879978

SCHEMBL5879978

Cc1ncccc1C(=O)NN=Cc1ccccc1OS(=O)(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.51
LMNA P02545 8/20 0.51
HTT P42858 6/20 0.51
KMT2A Q03164 5/20 0.51
MEN1 O00255 3/20 0.51
ALDH1A1 P00352 6/20 0.49
GAA P10253 2/20 0.46
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
EYA2 O00167 1/20 0.42
POLB P06746 1/20 0.42
PTBP1 P26599 1/20 0.42

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
SCHEMBL5879976 1.00 MAPT (0.51) MAPTLMNAHTTKMT2AMEN1
SCHEMBL5879964 0.90 LMNA (0.46) MAPTLMNAHTTKMT2AMEN1
SCHEMBL5879967 0.90 LMNA (0.46) MAPTLMNAHTTKMT2AMEN1
SCHEMBL6374926 0.89 MAPT (0.54) MAPTLMNAHTTKMT2AMEN1
SCHEMBL5880054 0.89 MAPT (0.54) MAPTLMNAHTTKMT2AMEN1
SCHEMBL5880183 0.88 ALDH1A1 (0.53) MAPTLMNAHTTKMT2AMEN1
SCHEMBL5880179 0.88 ALDH1A1 (0.53) MAPTLMNAHTTKMT2AMEN1
SCHEMBL6379352 0.87 LMNA (0.57) MAPTLMNAHTTKMT2AMEN1
SCHEMBL5879870 0.87 LMNA (0.57) MAPTLMNAHTTKMT2AMEN1
SCHEMBL6372497 0.86 MAPT (0.53) MAPTLMNAHTTKMT2AMEN1

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
US-7026339-B2 Inhibitors of HCV NS5B polymerase PFIZER INC. 2006-04-11 US disclosed
US-20050154056-A1 [(hetero)aryl or cycloalkylacetylhydrazono]methylbenzene derivatives, o-substituted with (hetero)aryl- or cycloalkyl- sulfonyloxy-, sulfonylamino-, S(O)0-2methyl-, or methoxy- groups, e.g., 3-chloro-2-((E)-{[(3-methoxyphenyl)acetyl]hydrazono}methyl)phenyl 4-(trifluoromethyl)benzenesulfonate PHARMACIA & UPJOHN COMPANY 2005-07-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050154056-A1 [(hetero)aryl or cycloalkylacetylhydrazono]methylbenzene derivatives, o-substituted with (hetero)aryl- or cycloalkyl- sulfonyloxy-, sulfonylamino-, S(O)0-2methyl-, or methoxy- groups, e.g., 3-chloro-2-((E)-{[(3-methoxyphenyl)acetyl]hydrazono}methyl)phenyl 4-(trifluoromethyl)benzenesulfonate ACACB, HCCS, HAVCR2 MAPT 4629/4885LMNA 4281/4885HTT 814/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.