SCHEMBL3580933

SCHEMBL3580933

CC(C)(CN1CCCC1)Oc1cc[c]cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 4/20 0.36
ACVRL1 P37023 3/20 0.36
ACVR1B P36896 2/20 0.36
BMPR1B O00238 2/20 0.36
KDM4E B2RXH2 1/20 0.36
BMPR1A P36894 1/20 0.36
PSMB1 P20618 2/20 0.36
PSMB5 P28074 2/20 0.36
PSMB2 P49721 2/20 0.36
HRH3 Q9Y5N1 5/20 0.35
GPR119 Q8TDV5 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAOB P27338 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3572933 0.87 ALDH1A1 (0.43) KDM4EHRH3ALDH1A1SLC6A4ATM
SCHEMBL3571206 0.80 ATM (0.46) ACVR1ACVRL1ACVR1BBMPR1BKDM4E
SCHEMBL16112300 0.79 ALDH1A1 (0.46) ACVR1ACVRL1ACVR1BBMPR1BKDM4E
SCHEMBL16112920 0.79 ATM (0.49) ACVR1ACVRL1ACVR1BBMPR1BKDM4E
SCHEMBL16112171 0.73 HRH3 (0.51) KDM4EHRH3ALDH1A1SMN1; SMN2SLC6A4
SCHEMBL2702794 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9115553 0.71 CYP3A4 (0.30) SMN1; SMN2
SCHEMBL3572159 0.71 PPARA (0.34)
SCHEMBL8960077 0.71
SCHEMBL1353598 0.71 TAAR1 (0.30)

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
US-7705023-B2 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2010-04-27 US disclosed
EP-1778632-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-08-20 EP disclosed
US-20070287715-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2007-12-13 US disclosed
EP-1778632-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 EP disclosed
WO-2005123673-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 WO 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-20070287715-A1 Indoles Useful in the Treatment of Inflammation PTGS1, IDO1, PTGES ACVR1 2847/4885ACVRL1 3696/4885ACVR1B 2919/4885

“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.