SCHEMBL10245924

SCHEMBL10245924

CC(=O)Oc1cc(C(=O)Nc2cccc(I)c2)ccc1F

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 4/20 0.64
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
PKM P14618 3/20 0.49
POLB P06746 2/20 0.49
HTT P42858 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
RECQL P46063 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 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
SCHEMBL10192542 0.82 MEN1 (0.53) KMT2AMEN1POLB
SCHEMBL3673898 0.75 KCNK3 (0.61) TOP1KMT2AMEN1PKMPOLB
SCHEMBL21146096 0.74 NPC1 (0.54) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL179004 0.73 TOP1 (0.83) TOP1KMT2AMEN1PKMPOLB
SCHEMBL25872216 0.73 KCNK3 (0.62) KMT2AMEN1TDP1NPC1RAB9A
SCHEMBL6469977 0.72 NPC1 (0.71) KMT2AMEN1HTTNPC1RAB9A
SCHEMBL27835354 0.71 NQO2 (0.59) TOP1KMT2AMEN1LMNARECQL
SCHEMBL6530432 0.71 KCNK3 (0.76) KMT2AMEN1POLBALDH1A1NPC1
SCHEMBL30799014 0.71 KCNK3 (0.76) KMT2AMEN1POLBALDH1A1NPC1
SCHEMBL6848357 0.71 ALDH1A1 (0.71) KMT2AMEN1PKMHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108592-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES ROMARK LABORATORIES, L.C. 2012-05-03 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-20120108592-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES PYGL, GYS2, GLS2 TOP1 2562/4885KMT2A 3654/4885MEN1 4455/4885

“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.