SCHEMBL2244976

SCHEMBL2244976

O=[C]N1CCC(Oc2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.50
NAAA Q02083 1/20 0.46
HRH1 P35367 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLC6A2 P23975 2/20 0.42
SLC6A3 Q01959 2/20 0.42
FFAR4 Q5NUL3 3/20 0.42
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41
SLC6A4 P31645 2/20 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
SCHEMBL10262302 0.75 SMN1; SMN2 (0.59) HRH1CARM1PRMT6SMN1; SMN2SLC6A2
SCHEMBL10261345 0.75 SMN1; SMN2 (0.59) HRH1CARM1PRMT6SMN1; SMN2SLC6A2
SCHEMBL714763 0.75 SMN1; SMN2 (0.59) HRH1CARM1PRMT6SMN1; SMN2SLC6A2
SCHEMBL2244980 0.75 SMN1; SMN2 (0.48) USP30HRH1CARM1PRMT6SMN1; SMN2
SCHEMBL25004994 0.74 HRH1 (0.47) USP30HRH1CARM1PRMT6SMN1; SMN2
SCHEMBL17476199 0.74 HRH1 (0.47) USP30HRH1CARM1PRMT6SMN1; SMN2
SCHEMBL2532124 0.73 EPHX2 (0.53) USP30FFAR4CHRM2CHRM3
SCHEMBL796833 0.73 EPHX2 (0.53) USP30FFAR4CHRM2CHRM3
SCHEMBL21274124 0.73 CARM1 (0.54) HRH1CARM1PRMT6SMN1; SMN2SLC6A2
SCHEMBL796858 0.73 EPHX2 (0.53) USP30FFAR4CHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US disclosed
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
EP-2447264-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-05-02 EP disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
EP-2243779-A1 BICYCLIC HETEROCYCLIC DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2010-10-27 EP disclosed
US-20100056497-A1 AMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-03-04 US disclosed
EP-2119702-A1 AMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2009-11-18 EP 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 (3 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-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE REN, AGTR1, AGTR2 USP30 3836/4885NAAA 1290/4885HRH1 256/4885
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE REN, AGTR1, AGTR2 USP30 3904/4885NAAA 460/4885HRH1 372/4885
US-20100056497-A1 AMIDE DERIVATIVE REN, AGTR1, AGTR2 USP30 3581/4885NAAA 76/4885HRH1 192/4885

“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.