SCHEMBL19102433

SCHEMBL19102433

CC1(C)C=C(I)CC(C)(C)N1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ GLA P06280 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL5599082 0.73 SMN1; SMN2 (0.46) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL5489748 0.71 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL4253446 0.71 SMN1; SMN2 (0.53) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL20936054 0.71 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL15329364 0.67 SMN1; SMN2 (0.41) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL11134639 0.67 SMN1; SMN2 (0.41) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL12499138 0.67 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL14564596 0.66 SMN1; SMN2 (0.40) SMN1; SMN2GLAKMT2AL3MBTL1
SCHEMBL20170045 0.66 SMN1; SMN2 (0.43) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL5599103 0.66 KMT2A (0.49) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210369716-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS AG (CH) 2021-12-02 — — US disclosed
US-11123348-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2021-09-21 — — US disclosed
US-20200179391-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS INSTITUTE FOR FUNCTIONAL GENOMICS, INC. DBA THE GENOMICS INSTITUTE OF THE NOVARTIS RESEARCH FOUNDATION 2020-06-11 — — US disclosed
US-10596175-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2020-03-24 — — US disclosed
US-20190000852-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS INSTITUTE FOR FUNCTIONAL GENOMICS, INC., DBA GENOMICS INSTITUTE OF THE NOVARTIS RESEARCH FOUNDATION 2019-01-03 — — US disclosed
US-9700559-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2017-07-11 — — 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 (5 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-20190000852-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-11123348-B2 Compounds and compositions for the treatment of parasitic diseases TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-10596175-B2 Compounds and compositions for the treatment of parasitic diseases TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-20210369716-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-20200179391-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885

“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.

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