SCHEMBL6645816

SCHEMBL6645816

N#CC1CCN2CCCC2C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 2/20 0.36
L3MBTL3 Q96JM7 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
HTR6 P50406 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL19193029 0.88 KDM2B (0.33) KDM2BL3MBTL3HRH3HTR6
SCHEMBL28002021 0.85 KDM2B (0.34) KDM2BL3MBTL3
SCHEMBL147003 0.85 SLC6A4 (0.35) KDM2BL3MBTL3HTR6
SCHEMBL151490 0.83 SLC6A4 (0.37) KDM2BL3MBTL3HTR6
SCHEMBL149070 0.83 SLC6A4 (0.37) KDM2BL3MBTL3HTR6
SCHEMBL9047777 0.83 KDM2B (0.39) KDM2BL3MBTL3
SCHEMBL6636518 0.83 KDM2B (0.39) KDM2BL3MBTL3
SCHEMBL9045610 0.83 KDM2B (0.39) KDM2BL3MBTL3
SCHEMBL31610339 0.79 KDM2B (0.39) KDM2BL3MBTL3
SCHEMBL20096220 0.78 HRH3 (0.44) KDM2BL3MBTL3HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-09-09 US disclosed
EP-1396488-A1 FUSED HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-03-10 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 (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-20040176361-A1 Fused heterocyclic compound and medicinal use thereof PARP11, PARP1, CD38 KDM2B 2367/4885L3MBTL3 4163/4885HRH3 2016/4885

“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.