SCHEMBL6489583

SCHEMBL6489583

O=C(CN1CC2CCC(C1)N2c1ncnc2sccc12)Nc1ccccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.45
STAT3 P40763 3/20 0.44
NR2F2 P24468 2/20 0.44
POLB P06746 2/20 0.42
GFER P55789 1/20 0.41
KDR P35968 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
KCNA5 P22460 2/20 0.41
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL6334410 0.91 HPGD (0.45) HPGDSTAT3NR2F2POLBGFER
SCHEMBL6334408 0.91 HPGD (0.45) HPGDSTAT3NR2F2POLBGFER
SCHEMBL6335058 0.81 DHPS (0.37) STAT3NR2F2POLBL3MBTL1MAPK1
SCHEMBL6332762 0.81 MEN1 (0.44) HPGDSTAT3NR2F2POLBL3MBTL1
SCHEMBL6332759 0.81 MEN1 (0.44) HPGDSTAT3NR2F2POLBL3MBTL1
SCHEMBL27579335 0.80 MAPK1 (0.40) STAT3NR2F2POLBL3MBTL1MAPK1
SCHEMBL6336984 0.78 HTT (0.52) STAT3NR2F2MAPK1KMT2AMAPT
SCHEMBL6336980 0.78 HTT (0.52) STAT3NR2F2MAPK1KMT2AMAPT
SCHEMBL6336890 0.77 HPGD (0.48) HPGDPOLBGFERKDRL3MBTL1
SCHEMBL27572530 0.77 MAPK1 (0.38) STAT3NR2F2POLBL3MBTL1MAPK1

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-20050272745-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB 2005-12-08 US claimed
US-20050272745-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB 2005-12-08 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-20050272745-A1 Novel piperidine and piperazine derivatives CYP3A5, IL5, ABCC5 HPGD 416/4885STAT3 2251/4885NR2F2 2242/4885

“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.