SCHEMBL14817522

SCHEMBL14817522

CC(=S)NC(=O)Cc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.56
▸ EGFR P00533 5/20 0.54
▸ ERBB2 P04626 5/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CA12 O43570 1/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48

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
SCHEMBL15948799 0.85 GAA (0.59) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL171965 0.83 LMNA (0.55) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL10202342 0.83 TDP1 (0.55) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL13926590 0.82 GAA (0.56) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL14817549 0.81 ALDH1A1 (0.61) GAATDP1KMT2ALMNAALDH1A1
SCHEMBL13664095 0.81 KDM4E (0.56) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL14839502 0.81 GAA (0.54) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL13620061 0.80 TDP1 (0.53) GAATDP1SMN1; SMN2KMT2ALMNA
SCHEMBL15145925 0.79 LMNA (0.55) GAAEGFRERBB2TDP1SMN1; SMN2
SCHEMBL13608024 0.79 KDM4E (0.57) GAAEGFRERBB2TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846927-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-09-30 — — US disclosed
US-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2013-06-27 — — US disclosed
US-8404846-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-03-26 — — 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-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET GAA 764/4885EGFR 6/4885ERBB2 2/4885

“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.

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