SCHEMBL6337116

SCHEMBL6337116

Cc1c(NC(=O)CN2CC3CC[C@@H](C2)N3c2ncnc3c2ncn3C)ccc2c1S(=O)(=O)C(=O)N2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.34
PIK3R1 P27986 1/20 0.34
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PI4KB Q9UBF8 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
SCHEMBL6335936 0.80 MEN1 (0.44) MEN1KMT2A
SCHEMBL6334571 0.74 P2RX7 (0.46) MEN1KMT2A
SCHEMBL6404299 0.73 BRAF (0.37) MEN1KMT2A
SCHEMBL6408514 0.73 KDM4E (0.36) MEN1KMT2A
SCHEMBL6489320 0.70 HPGD (0.46) HSD17B10MEN1KMT2A
SCHEMBL6334422 0.70 HPGD (0.46) HSD17B10MEN1KMT2A
SCHEMBL6343579 0.64 SMN1; SMN2 (0.40) HSD17B10MEN1KMT2A
SCHEMBL6336265 0.64 PI4KB (0.43) MEN1KMT2API4KB
SCHEMBL6334489 0.64 ADORA1 (0.38) PIK3CDPIK3R1
SCHEMBL6334486 0.64 ADORA1 (0.38) PIK3CDPIK3R1

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-6969713-B2 Piperidine and piperazine acetamide derivatives ASTRAZENECA AB (SE) 2005-11-29 US disclosed
US-20030013721-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2003-01-16 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-20030013721-A1 Novel piperidine and piperazine derivatives IL5, VIP, EP300 PIK3CD 376/4885PIK3R1 1159/4885HSD17B10 3838/4885

“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.