SCHEMBL19035709

SCHEMBL19035709

c1cnc(N2CCCN(C3CC3)CC2)cn1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.49
CHRM4 P08173 1/20 0.49
KDM4E B2RXH2 2/20 0.46
SORD Q00796 1/20 0.43
DPP4 P27487 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP7 Q9UHL4 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GPR119 Q8TDV5 1/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL14161926 0.94 KDM4E (0.50) CHRM2CHRM4KDM4ESORDDPP4
SCHEMBL14161712 0.83 MAP4K4 (0.47) CHRM2CHRM4KDM4E
SCHEMBL19035556 0.82 HRH3 (0.51) CHRM2CHRM4KDM4EDPP4DPP8
SCHEMBL4130328 0.81 CHRM4 (0.47) CHRM2CHRM4KDM4ESORDDPP4
SCHEMBL2320496 0.79 SORD (0.51) KDM4ESORDLMNAL3MBTL1GPR119
SCHEMBL31014265 0.79 SORD (0.51) KDM4ESORDLMNAL3MBTL1GPR119
SCHEMBL18228513 0.79 SORD (0.51) KDM4ESORDLMNAL3MBTL1GPR119
SCHEMBL4019738 0.79 ROCK2 (0.48) CHRM2CHRM4
SCHEMBL81925 0.78 KCNH2 (0.42) GPR119
SCHEMBL468382 0.77 SORD (0.50) KDM4ESORDLMNAL3MBTL1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10301267-B2 Compounds ASTRAZENECA AB (SE) 2019-05-28 US disclosed
US-20170260143-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2017-09-14 US disclosed
US-9688640-B2 Methods of treating cancer with a pyrazole derivative ASTRAZENECA AB (SE) 2017-06-27 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-10301267-B2 Compounds SLC10A1, CYP11B1, ABCB11 CHRM2 4554/4885CHRM4 4739/4885KDM4E 2865/4885
US-20170260143-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 CHRM2 4461/4885CHRM4 4662/4885KDM4E 3393/4885

“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.