SCHEMBL4506399

SCHEMBL4506399

Cc1cc(OC(C)C)c(NC(=O)CN2CCN(CCSc3nc4ncccc4o3)CC2)c(OC(C)C)n1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 12/20 0.69
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.42
SHMT2 P34897 3/20 0.42
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL4525437 0.89 SOAT1 (0.68) SOAT1POLB
SCHEMBL6286120 0.82 SOAT1 (1.00) SOAT1POLB
SCHEMBL6280750 0.81 SOAT1 (1.00) SOAT1POLBLMNASHMT2
Hydrochloric Acid SCHEMBL6282102 0.81 SOAT1 (0.78) SOAT1POLBLMNASHMT2THRB
SCHEMBL282683 0.80 SOAT1 (1.00) SOAT1POLBLMNASHMT2TP53
SCHEMBL6282168 0.79 SOAT1 (0.81) SOAT1POLBLMNASHMT2TP53
SCHEMBL4526190 0.79 SOAT1 (0.68) SOAT1POLBLMNASHMT2TP53
SCHEMBL4526617 0.78 SOAT1 (0.67) SOAT1POLBLMNASHMT2TP53
SCHEMBL6278992 0.78 SOAT1 (0.88) SOAT1POLBLMNASHMT2TP53
SCHEMBL6278513 0.77 SOAT1 (0.90) SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7560547-B2 Hydroxyalkyl cyclic diamine compounds KOWA CO., LTD. (JP) 2009-07-14 US disclosed
US-20070088159-A1 HYDROXYALKYL CYCLIC DIAMINE COMPOUNDS KOWA CO., LTD. (JP) 2007-04-19 US disclosed
US-7176306-B2 Hydroxyalkyl cyclic diamine compound KOWA CO., LTD. (JP) 2007-02-13 US disclosed
EP-1571144-A1 HYDROXYALKYLATED CYCLIC DIAMINE COMPOUND Kowa Co., Ltd. (JP) 2005-09-07 EP disclosed
US-20040176593-A1 Hydroxyalkyl cyclic diamine compound KOWA CO., LTD. (JP) 2004-09-09 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 (2 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-20040176593-A1 Hydroxyalkyl cyclic diamine compound DDC, AOC1, ODC1 SOAT1 1314/4885POLB 685/4885LMNA 4821/4885
US-20070088159-A1 HYDROXYALKYL CYCLIC DIAMINE COMPOUNDS HDHD5, DDC, DDT SOAT1 1023/4885POLB 281/4885LMNA 4773/4885

“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.