SCHEMBL6413259

SCHEMBL6413259

O=C(CBr)CC(=O)Nc1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.58
ALDH1A1 P00352 4/20 0.54
HDAC3 O15379 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
THRB P10828 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
ATM Q13315 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL1525924 0.86 GAA (0.63) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL1753925 0.84 GAA (0.70) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL23088339 0.83 KMT2A (0.74) ALDH1A1KMT2ASMN1; SMN2POLBKDM4E
SCHEMBL6414674 0.81 POLB (0.71) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL11739018 0.81 GAA (0.58) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL6407780 0.81 KMT2A (0.56) GAAALDH1A1KMT2ASMN1; SMN2POLB
SCHEMBL9386081 0.81 HDAC3 (0.64) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL3986889 0.81 EPHX2 (0.55) GAAHDAC3HDAC1HDAC2HDAC6
SCHEMBL105772 0.79 GAA (0.63) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL6407607 0.77 L3MBTL1 (0.63) ALDH1A1HDAC3HDAC1HDAC2HDAC6

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-6921770-B2 2-Phenyliminothiazolines, their preparation method and anti-rice blast agent containing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2005-07-26 US disclosed
US-20030203950-A1 2-Phenyliminothiazolines, their preparation method and anti-rice blast agent containing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-10-30 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-20030203950-A1 2-Phenyliminothiazolines, their preparation method and anti-rice blast agent containing the same TYR, SYPL1, SSBP1 GAA 2297/4885ALDH1A1 4656/4885HDAC3 4884/4885

“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.