SCHEMBL13265451

SCHEMBL13265451

CCC(=O)OCCCN1CCN(C)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.48
HRH3 Q9Y5N1 4/20 0.48
DRD3 P35462 2/20 0.48
PAOX Q6QHF9 1/20 0.47
RAB9A P51151 2/20 0.44
HRH2 P25021 7/20 0.44
HRH1 P35367 7/20 0.44
SLC29A1 Q99808 1/20 0.42
NPC1 O15118 1/20 0.42
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL10174987 0.89 ALDH1A1 (0.48) NAAAHRH3DRD3PAOXRAB9A
SCHEMBL11025698 0.84 HRH3 (0.47) HRH3DRD3PAOXRAB9AHRH2
SCHEMBL562204 0.84 HRH3 (0.47) HRH3DRD3PAOXRAB9AHRH2
SCHEMBL13265466 0.83 HRH3 (0.54) NAAAHRH3THRBUSP2ALDH1A1
SCHEMBL9326877 0.83 GAA (0.49) NAAAHRH3DRD3HRH2HRH1
SCHEMBL16845085 0.81 HRH3 (0.50) HRH3DRD3PAOXRAB9ASLC29A1
SCHEMBL1301323 0.80 HRH3 (0.49) HRH3DRD3PAOXRAB9ASLC29A1
SCHEMBL14641556 0.80 HRH3 (0.49) HRH3DRD3PAOXRAB9ASLC29A1
SCHEMBL12879889 0.79 PAOX (0.49) HRH3DRD3PAOXRAB9AHRH2
SCHEMBL13601497 0.79 THRB (0.56) NAAAHRH3PAOXRAB9AHRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759356-B2 Arylindenopyridines and arylindenopyrimidines and related therapeutic and prophylactic methods JANSSEN PHARMACEUTICA, N.V. (BE) 2010-07-20 US disclosed
US-7754730-B2 Arylindenopyridines and arylindenopyrimidines and related therapeutic and prophylactic methods ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2010-07-13 US disclosed
US-20090054429-A1 ARYLINDENOPYRIDINES AND ARYLINDENOPYRIMIDINES AND RELATED THERAPEUTIC AND PROPHYLACTIC METHODS JANSSEN PHARMACEUTICA NV (BE) 2009-02-26 US disclosed
US-7468373-B2 Arylindenopyridines and arylindenopyrimidines and related therapeutic and prophylactic methods ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2008-12-23 US disclosed
US-7345052-B2 Arylindenopyridines and arylindenopyrimidines and related therapeutic and prophylactic methods ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2008-03-18 US disclosed
US-20070155760-A1 ARYLINDENOPYRIDINES AND ARYLINDENOPYRIMIDINES AND RELATED THERAPEUTIC AND PROPHYLACTIC METHODS JANSSEN PHARMACEUTICA NV (BE) 2007-07-05 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-20070155760-A1 ARYLINDENOPYRIDINES AND ARYLINDENOPYRIMIDINES AND RELATED THERAPEUTIC AND PROPHYLACTIC METHODS ADORA2A, ADORA1, ADORA3 NAAA 2509/4885HRH3 141/4885DRD3 375/4885
US-20090054429-A1 ARYLINDENOPYRIDINES AND ARYLINDENOPYRIMIDINES AND RELATED THERAPEUTIC AND PROPHYLACTIC METHODS ADORA2A, ADORA1, ADORA3 NAAA 2509/4885HRH3 141/4885DRD3 375/4885

“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.