SCHEMBL6133607

SCHEMBL6133607

NC(=O)c1cn(C[C@@H](O)CCCc2ccccc2OCCSc2ccc(Cl)cc2)cn1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADA P00813 10/20 0.36
PKM P14618 1/20 0.35
PPARD Q03181 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL6133502 0.89 ADA (0.43) ADAPPARD
Hydrochloric Acid SCHEMBL6133494 0.88 ADA (0.39) ADAPPARD
Hydrochloric Acid SCHEMBL6134584 0.85 SLC1A5 (0.42) GAASMN1; SMN2ADAPOLBKMT2A
SCHEMBL6134545 0.85 MMP3 (0.36) ADAPPARDNPC1
SCHEMBL6172343 0.83 ADA (0.47) LMNAADA
SCHEMBL6170903 0.82 MEN1 (0.45) LMNAADAMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL6133251 0.82 ADA (0.37) LMNAADAMEN1KMT2AMAPT
SCHEMBL6172025 0.81 LPAR1 (0.42) LMNASMN1; SMN2ADA
Hydrochloric Acid SCHEMBL6133445 0.81 HRH1 (0.40) ADA
SCHEMBL6170939 0.80 ADA (0.45) HTTADA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908940-B2 Imidazole compounds and their use as adenosine deaminase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-21 US claimed
US-20040097571-A1 Imidazole compounds and their use as adenosine deaminase inhibitors ASTELLAS PHARMA INC. (JP) 2004-05-20 US claimed
US-6908940-B2 Imidazole compounds and their use as adenosine deaminase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-21 US disclosed
US-20040097571-A1 Imidazole compounds and their use as adenosine deaminase inhibitors ASTELLAS PHARMA INC. (JP) 2004-05-20 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-20040097571-A1 Imidazole compounds and their use as adenosine deaminase inhibitors ADA, AMPD2, AMPD1 HTT 3158/4885LMNA 2771/4885HPGD 261/4885

“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.