SCHEMBL20109499

SCHEMBL20109499

COc1ccc(CC2CCCCN2)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.63
LTA4H P09960 7/20 0.50
ALDH1A1 P00352 1/20 0.50
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 1/20 0.48
EPHX2 P34913 1/20 0.46

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
SCHEMBL18019872 1.00 POLB (0.63) POLBLTA4HALDH1A1SLC6A2SLC6A4
SCHEMBL18019867 1.00 POLB (0.63) POLBLTA4HALDH1A1SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL7155487 0.98 POLB (0.61) POLBLTA4HALDH1A1SLC6A2SLC6A4
SCHEMBL11486260 0.98 POLB (0.61) POLBLTA4HALDH1A1SLC6A2SLC6A4
SCHEMBL3167638 0.95 POLB (0.56) POLBLTA4HALDH1A1
SCHEMBL14417554 0.95 POLB (0.56) POLBLTA4HALDH1A1
Hydrochloric Acid SCHEMBL11373827 0.94 POLB (0.54) POLBLTA4HALDH1A1
Oxalic Acid SCHEMBL23458982 0.90 POLB (0.56) POLBLTA4HALDH1A1SLC6A2SLC6A4
Oxalic Acid SCHEMBL1443439 0.87 POLB (0.51) POLBLTA4HALDH1A1EPHX2
SCHEMBL23255515 0.86 ALDH1A1 (0.48) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240343733-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS C4 THERAPEUTICS, INC. 2024-10-17 US disclosed
EP-4367113-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS Biogen MA Inc. (US) 2024-05-15 EP disclosed
CN-117940414-A Compounds for targeting IRAK4 protein degradation 渤健马萨诸塞州股份有限公司 2024-04-26 CN disclosed
WO-2023283610-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS BIOGEN MA INC. (US) 2023-01-12 WO disclosed
WO-2023283610-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS BIOGEN MA INC. (US) 2023-01-12 WO disclosed
US-20180118721-A1 PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-03 US disclosed
US-20180118721-A1 PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-03 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 (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-20180118721-A1 PYRIMIDINE DERIVATIVES MTHFD1, TYMS, DPYD POLB 546/4885LTA4H 2513/4885ALDH1A1 216/4885
US-20240343733-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS IRAK4, IRAK2, IRAK1 POLB 3167/4885LTA4H 2560/4885ALDH1A1 2273/4885

“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.