SCHEMBL3572933

SCHEMBL3572933

CN1CCN(CC(C)(C)Oc2cc[c]cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
RECQL P46063 1/20 0.35
KDM4E B2RXH2 4/20 0.35
GLA P06280 1/20 0.35
MC4R P32245 1/20 0.34
USP2 O75604 1/20 0.34
HPGD P15428 1/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
DRD3 P35462 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
TP53 P04637 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL3580933 0.87 ACVR1 (0.36) ALDH1A1MEN1KMT2AATMKDM4E
SCHEMBL22209233 0.73 PPARG (0.52) ALDH1A1HTTMEN1KMT2AATM
SCHEMBL183199 0.72 LTA4H (0.59) ALDH1A1MEN1KMT2AKDM4EUSP2
SCHEMBL2182974 0.71 RAB9A (0.61) ALDH1A1USP2HPGDRAB9ANPC1
SCHEMBL2702794 0.70 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL2983140 0.70 HPGD (0.68) ALDH1A1USP2HPGDRAB9ANPC1
SCHEMBL8020121 0.69 SIGMAR1 (0.56) ALDH1A1MEN1KMT2AKDM4EMC4R
SCHEMBL8960077 0.69
SCHEMBL9115553 0.69 CYP3A4 (0.30)
SCHEMBL3572159 0.69 PPARA (0.34)

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 ALDH1A1 475/4885HTT 2830/4885MEN1 3621/4885

“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.