SCHEMBL7604480

SCHEMBL7604480

Cc1ccc(N2CCC(N(C)C(=O)c3ccccc3)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.54
USP30 Q70CQ3 2/20 0.51
HRH3 Q9Y5N1 11/20 0.49
PDK2 Q15119 1/20 0.47
KCNH2 Q12809 3/20 0.47
KDM5A P29375 1/20 0.46

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
SCHEMBL11554342 0.84 USP30 (0.53) MCHR1USP30HRH3KCNH2
SCHEMBL1749343 0.79 HRH3 (0.59) MCHR1HRH3
SCHEMBL3333340 0.78 HRH3 (0.61) MCHR1USP30HRH3KDM5A
SCHEMBL17888295 0.77 MCHR1 (0.61) MCHR1USP30HRH3PDK2
SCHEMBL17888467 0.77 CHRM4 (0.56) USP30HRH3
SCHEMBL14450799 0.76 MCHR1 (0.49) MCHR1KCNH2
SCHEMBL27389111 0.76 MCHR1 (0.49) MCHR1KCNH2
SCHEMBL14924424 0.76 MCHR1 (0.49) MCHR1KCNH2
SCHEMBL8228122 0.75 HSD17B10 (0.51) MCHR1USP30HRH3KCNH2KDM5A
SCHEMBL3329900 0.75 CCR5 (0.55) MCHR1USP30HRH3

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-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-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
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 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-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE REN, AGTR1, AGTR2 MCHR1 608/4885USP30 3836/4885HRH3 184/4885
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE REN, AGTR1, AGTR2 MCHR1 966/4885USP30 3904/4885HRH3 117/4885

“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.