SCHEMBL4183440

SCHEMBL4183440

CCN(CC)S(=O)(=O)c1ccc(Nc2cc(Oc3ccc(C)nc3C)ccn2)cc1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 17/20 0.73
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL4168353 0.89 TGFBR1 (0.77) TGFBR1
SCHEMBL4174543 0.86 TGFBR1 (0.82) TGFBR1
SCHEMBL4172888 0.85 TGFBR1 (0.68) TGFBR1
SCHEMBL373618 0.85 TGFBR1 (1.00) TGFBR1
SCHEMBL29429424 0.85 TGFBR1 (1.00) TGFBR1
SCHEMBL29657184 0.85 TGFBR1 (1.00) TGFBR1
SCHEMBL4172942 0.84 TGFBR1 (0.79) TGFBR1
SCHEMBL4177684 0.81 TGFBR1 (0.68) TGFBR1LMNAGAAMAPTHTT
SCHEMBL4170271 0.81 TGFBR1 (0.71) TGFBR1
SCHEMBL3946083 0.80 TGFBR1 (0.73) TGFBR1ALDH1A1

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-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 TGFBR1 1/4885LMNA 2739/4885MEN1 218/4885

“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.