SCHEMBL10049519

SCHEMBL10049519

CCOC1CC(C)CCC1C

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL11934383 0.82 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2
SCHEMBL11934382 0.81 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2
SCHEMBL12734516 0.80
SCHEMBL13072126 0.80
SCHEMBL21863945 0.78 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL12165152 0.78 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL11815766 0.78 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL3378961 0.75 ALDH1A1 (0.63) ALDH1A1
SCHEMBL16518811 0.75 ALDH1A1 (0.63) ALDH1A1
SCHEMBL11913504 0.75 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2

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
WO-2021087083-A1 USE OF ITACONATE AND ITS DERIVATIVES/ANALOGUES TO INDUCE HAIR GROWTH THE JOHNS HOPKINS UNIVERSITY (US) 2021-05-06 WO disclosed
US-8211932-B2 Organic compounds and their uses NOVARTIS AG (CH) 2012-07-03 US disclosed
US-8110339-B2 Multi-tone resist compositions MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-02-07 US disclosed
US-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-30 US disclosed
US-20090068589-A1 MULTI-TONE RESIST COMPOSITIONS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-03-12 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-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 ALDH1A1 135/4885SMN1; SMN2 877/4885

“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.