SCHEMBL29535792

SCHEMBL29535792

CCOc1ccc(Cc2cc(C)n(C(C)C)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46
BCHE P06276 2/20 0.41
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
NQO1 P15559 1/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CNR2 P34972 2/20 0.39
DHFR P00374 1/20 0.39
MPO P05164 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
ABL1 P00519 1/20 0.37
HCK P08631 1/20 0.37
SRC P12931 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
CASP3 P42574 1/20 0.37

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
SCHEMBL4985181 0.77 ALDH1A1 (0.42) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL14375488 0.72 MPO (0.42) MPOABL1HCKSRC
SCHEMBL2488793 0.70 NQO1 (0.74) SMN1; SMN2LMNANQO1HPGDKDM4E
SCHEMBL8600030 0.69 SMN1; SMN2 (0.45) SMN1; SMN2LMNABCHENQO1HPGD
SCHEMBL19452835 0.68
SCHEMBL13400766 0.67 NQO1 (0.61) SMN1; SMN2LMNANQO1HPGDKDM4E
SCHEMBL10064922 0.67 SLC5A1 (0.57) SMN1; SMN2LMNATP53POLBHPGD
SCHEMBL23544689 0.66 NQO1 (0.54) SMN1; SMN2LMNANQO1HPGDKDM4E
SCHEMBL14175640 0.66 NQO1 (0.58) SMN1; SMN2LMNANQO1HPGDKDM4E
SCHEMBL15201648 0.65 NQO1 (0.64) SMN1; SMN2LMNANQO1HPGDKDM4E

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-12544396-B2 Compositions and methods for treating metabolic disease VOGENX (US) 2026-02-10 US disclosed
CN-114450011-B Compositions and methods for treating metabolic disorders 阿沃林特有限公司 2024-10-22 CN disclosed
US-20220257624-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DISEASE VOGENX 2022-08-18 US disclosed
CN-114450011-A Compositions and methods for treating metabolic disorders 阿沃林特有限公司 2022-05-06 CN disclosed
EP-3976053-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DISEASE Avolynt (US) 2022-04-06 EP 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-12544396-B2 Compositions and methods for treating metabolic disease SLC5A2, SLC5A1, SLC10A1 SMN1; SMN2 3128/4885LMNA 3319/4885BCHE 4169/4885
US-20220257624-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DISEASE SLC5A2, SLC5A1, SLC10A1 SMN1; SMN2 3782/4885LMNA 2913/4885BCHE 1885/4885

“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.