SCHEMBL6489320

SCHEMBL6489320

CC1CN(CC(=O)Nc2ccccc2Cl)CC(C)N1c1ncnc2c1ncn2C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
KCNA5 P22460 2/20 0.43
POLB P06746 2/20 0.43
GFER P55789 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 4/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
GAA P10253 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP1A2 P05177 1/20 0.41
MAPT P10636 1/20 0.41
KDR P35968 1/20 0.40
USP2 O75604 1/20 0.40
TSHR P16473 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
SCHEMBL6334422 1.00 HPGD (0.46) HPGDKCNA5POLBGFERL3MBTL1
SCHEMBL6336890 0.82 HPGD (0.48) HPGDKCNA5POLBGFERL3MBTL1
SCHEMBL6335936 0.81 MEN1 (0.44) HPGDPOLBL3MBTL1ALDH1A1LMNA
SCHEMBL6334486 0.80 ADORA1 (0.38) LMNACYP3A4CYP2D6CYP1A2
SCHEMBL6334410 0.79 HPGD (0.45) HPGDKCNA5POLBGFERL3MBTL1
SCHEMBL6334408 0.79 HPGD (0.45) HPGDKCNA5POLBGFERL3MBTL1
SCHEMBL6334571 0.76 P2RX7 (0.46) ALDH1A1LMNASMN1; SMN2KMT2AMEN1
SCHEMBL6491144 0.74 HPGD (0.38) HPGDKCNA5POLBGFERL3MBTL1
SCHEMBL6332661 0.72 PIK3CD (0.40) CYP3A4CYP2D6CYP1A2
SCHEMBL6404299 0.71 BRAF (0.37) L3MBTL1ALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1330657-C Piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2007-08-08 CN claimed
US-20050272745-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB 2005-12-08 US claimed
EP-1242427-B1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2003-08-13 EP claimed
CN-1434827-A Novel piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2003-08-06 CN claimed
CN-1330657-C Piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2007-08-08 CN disclosed
CN-1436232-A Variants with altered properties NOVOZYMES AS (DK) 2003-08-13 CN disclosed
CN-1434827-A Novel piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2003-08-06 CN 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 416/4885KCNA5 115/4885POLB 2266/4885

“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.