SCHEMBL7034883

SCHEMBL7034883

COC(=O)[C@H]1CC(=O)c2cc(C)ccc2C1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 1/20 0.51
ACHE P22303 1/20 0.46
MAPT P10636 3/20 0.41
METAP1 P53582 2/20 0.40
BUB1 O43683 1/20 0.40
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
LMNA P02545 1/20 0.39
MAOB P27338 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
BRD4 O60885 1/20 0.36

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
SCHEMBL30834248 1.00 KMT2A (0.52) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL9221702 0.83 ACHE (0.50) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL5859196 0.83 KMT2A (0.48) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL8911487 0.80 KMT2A (0.56) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL15519819 0.80 KMT2A (0.56) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL17515294 0.78 ACHE (0.55) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL11459078 0.76 ACHE (0.43) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL31293260 0.75 KMT2A (0.51) KMT2AALDH1A1KDM4EACHEBUB1
SCHEMBL5889332 0.75 FAAH (0.44) KMT2AALDH1A1KDM4EACHEMAPT
SCHEMBL9218363 0.75 FAAH (0.44) KMT2AALDH1A1KDM4EACHEMAPT

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-20030158266-A1 2-aminotetralines, a process for their preparation, and pharmaceutical compositions, for the prevention and therapeutic treatment of inflammatory and/or autoimmune pathologies SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. 2003-08-21 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-20030158266-A1 2-aminotetralines, a process for their preparation, and pharmaceutical compositions, for the prevention and therapeutic treatment of inflammatory and/or autoimmune pathologies AADAT, IL2, TPMT KMT2A 1188/4885ALDH1A1 3241/4885KDM4E 3491/4885

“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.