SCHEMBL5880179

SCHEMBL5880179

Cc1cccnc1C(=O)N/N=C/c1ccccc1OS(=O)(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
HTT P42858 5/20 0.53
MAPT P10636 9/20 0.50
LMNA P02545 8/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.50
GAA P10253 2/20 0.45
MAPK1 P28482 1/20 0.44
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 0.41
PTBP1 P26599 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
SCHEMBL5880183 1.00 ALDH1A1 (0.53) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5879976 0.88 MAPT (0.51) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5879978 0.88 MAPT (0.51) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL6374926 0.86 MAPT (0.54) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5880054 0.86 MAPT (0.54) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5879964 0.83 LMNA (0.46) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5879967 0.83 LMNA (0.46) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5880118 0.83 LMNA (0.58) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5880114 0.83 LMNA (0.58) ALDH1A1HTTMAPTLMNAKMT2A
SCHEMBL5880124 0.83 MAPT (0.58) ALDH1A1HTTMAPTLMNAKMT2A

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 ALDH1A1 1095/4885HTT 814/4885MAPT 4629/4885

“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.