SCHEMBL7047862

SCHEMBL7047862

CCCN1CCN(N2CC[N]CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.38
SIGMAR1 Q99720 2/20 0.38
SLC2A1 P11166 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
DRD3 P35462 1/20 0.33
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32

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
SCHEMBL42566 0.85
SCHEMBL1489852 0.77 DRD2 (0.34) DRD2SIGMAR1DRD3
SCHEMBL19546253 0.77 DRD2 (0.52) DRD2SIGMAR1DRD3GNAI3GNAO1
SCHEMBL681521 0.77
SCHEMBL1046369 0.77 DRD2 (0.52) DRD2SIGMAR1DRD3GNAI3GNAO1
SCHEMBL384210 0.77 DRD2 (0.52) DRD2SIGMAR1DRD3GNAI3GNAO1
SCHEMBL6512381 0.77 DRD2 (0.52) DRD2SIGMAR1DRD3GNAI3GNAO1
SCHEMBL6659994 0.74 DRD2 (0.50) DRD2SIGMAR1DRD3GNAI3GNAO1
Ammonia Solution, Strong SCHEMBL9858529 0.74
Bromide SCHEMBL6660052 0.72 DRD2 (0.48) DRD2SIGMAR1DRD3GNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2003-09-11 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-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use CYP2C19, DHPS, SDHA DRD2 2797/4885SIGMAR1 4345/4885SLC2A1 4504/4885

“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.