SCHEMBL8692979

SCHEMBL8692979

NC1CCC(C2CCCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.57
THRB P10828 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL21349634 1.00 ALDH1A1 (0.57) ALDH1A1THRBMEN1KMT2A
SCHEMBL20468321 1.00 ALDH1A1 (0.57) ALDH1A1THRBMEN1KMT2A
SCHEMBL4088388 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL23561000 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL23352964 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL23221351 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL13007137 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL18900975 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL8840602 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A
SCHEMBL69669 0.97 ALDH1A1 (0.53) ALDH1A1THRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3560499-A1 DIHYDROPTERIDINONES FOR THE TREATMENT OF CANCER DISEASES Boehringer Ingelheim International GmbH (DE) 2019-10-30 EP disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
US-5852023-A Cyclohexylamino and cycloalkoxy nitrogen heterocycles, processes for their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1998-12-22 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT ALDH1A1 2151/4885THRB 2871/4885MEN1 380/4885

“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.