SCHEMBL3065287

SCHEMBL3065287

CC(OC(=O)c1ccccn1)C1CCCN1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.44
SLC6A3 Q01959 8/20 0.41
SLC6A2 P23975 6/20 0.41
SLC6A4 P31645 4/20 0.41
DHFR P00374 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL3058944 0.77 ALDH1A1 (0.48) KMT2AALDH1A1LMNA
SCHEMBL27770641 0.76 SLC6A3 (0.41) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL27770700 0.76 KMT2A (0.51) KMT2ASLC6A3SLC6A2SLC6A4DHFR
SCHEMBL10508162 0.76 ALDH1A1 (0.44) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL27585717 0.75 CHRNB4 (0.39) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL29108416 0.74 KMT2A (0.48) KMT2AALDH1A1LMNA
SCHEMBL1873958 0.73 SLC6A3 (0.44) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL1878142 0.73 SLC6A3 (0.44) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL9944382 0.73 KMT2A (0.58) KMT2AALDH1A1LMNA
SCHEMBL30731163 0.73 KMT2A (0.58) KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100260671-A1 COMPOUNDS AND METHODS FOR THE DIAGNOSIS AND TREATMENT OF AMYLOID ASSOCIATED DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-10-14 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-20100260671-A1 COMPOUNDS AND METHODS FOR THE DIAGNOSIS AND TREATMENT OF AMYLOID ASSOCIATED DISEASES APP, HTT, SCN3A KMT2A 4071/4885SLC6A3 38/4885SLC6A2 101/4885

“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.