SCHEMBL6369701

SCHEMBL6369701

CCN1CCc2c(C)cccc2C1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.52
PNMT P11086 1/20 0.44
HTR2C P28335 1/20 0.41
KMT2A Q03164 1/20 0.41
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
PRMT1 Q99873 1/20 0.41
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
CYP2C19 P33261 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39

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
SCHEMBL6369549 0.86 PNMT (0.55) HRH3PNMTKMT2ADRD2DRD1
SCHEMBL13450138 0.84 SIGMAR1 (0.50) HRH3DRD2CYP2C19
SCHEMBL18376160 0.84 HTR2C (0.50) HRH3PNMTHTR2CKMT2ADRD2
SCHEMBL12681593 0.82 PRMT5 (0.41) HRH3KMT2ACARM1PRMT6PRMT1
SCHEMBL12681586 0.82 CARM1 (0.44) KMT2ACARM1PRMT6PRMT1PRMT5
SCHEMBL6369525 0.81 CARM1 (0.59) HRH3PNMTCARM1PRMT6PRMT1
SCHEMBL13171916 0.81 HRH3 (0.51) HRH3PNMTHTR2CKMT2ACARM1
SCHEMBL21216375 0.81 HRH3 (0.51) HRH3PNMTCARM1PRMT6PRMT1
SCHEMBL30238474 0.81 HRH3 (0.51) HRH3PNMTCARM1PRMT6PRMT1
SCHEMBL6369712 0.81 HRH3 (0.54) HRH3PNMTKMT2ACARM1PRMT6

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
WO-2016144703-A1 FLUORINATED LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2016-09-15 WO disclosed
US-8173672-B2 Quinolizidinone M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2012-05-08 US disclosed
US-20110046145-A1 Quinolizidinone M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME CORP. (US) 2011-02-24 US disclosed
WO-2009117283-A2 QUINOLIZIDINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK & CO., INC. (US) 2009-09-24 WO disclosed
US-7157463-B2 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-02 US disclosed
US-7157463-B2 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-02 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 (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-20110046145-A1 Quinolizidinone M1 Receptor Positive Allosteric Modulators CHRM1, CHRM2, OPRL1 HRH3 107/4885PNMT 470/4885HTR2C 123/4885

“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.