SCHEMBL16260143

SCHEMBL16260143

CC(C)NC(CCCNC(=N)N)C(=O)NCCCN(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.36
▸ NPY4R P50391 9/20 0.35
▸ NPY1R P25929 7/20 0.35
▸ NPY5R Q15761 5/20 0.35
▸ NPY2R P49146 3/20 0.35
▸ DNM1 Q05193 1/20 0.35
▸ AVPR1A P37288 1/20 0.34
▸ CXCL8 P10145 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ SIRT1 Q96EB6 1/20 0.33

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
SCHEMBL16263588 0.86 DNM1 (0.36) HPGDNPY4RNPY1RNPY5RNPY2R
SCHEMBL16260299 0.85 SIRT6 (0.40) NPY4RNPY1RNPY5RNPY2RSIRT6
SCHEMBL16260140 0.85 SIRT6 (0.40) NPY4RNPY1RNPY5RNPY2RSIRT6
SCHEMBL16260290 0.85 SIRT6 (0.43) NPY4RNPY1RNPY5RNPY2RSIRT6
SCHEMBL16260144 0.85 SIRT6 (0.43) NPY4RNPY1RNPY5RNPY2RSIRT6
SCHEMBL27113032 0.84 SIRT6 (0.48) SIRT6SIRT1
SCHEMBL27114204 0.83 SIRT6 (0.50) SIRT6SIRT1
SCHEMBL12837508 0.82 NPY4R (0.39) NPY4RNPY1RNPY5RNPY2R
SCHEMBL16263607 0.82 SIRT6 (0.38) NPY4RNPY1RNPY5RNPY2RSIRT6
SCHEMBL20620313 0.81 NPY4R (0.32) NPY4RNPY1RNPY5RNPY2RKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190002429-A1 Derivatives of Xanthone Compounds SINGAPORE HEALTH SERVICES PTE LTD (SG) 2019-01-03 — — US disclosed
US-20140349918-A1 DERIVATIVES OF XANTHONE COMPOUNDS SINGAPORE HEALTH SERVICES PTE LTD. (SG) 2014-11-27 — — US disclosed
US-20140349918-A1 DERIVATIVES OF XANTHONE COMPOUNDS SINGAPORE HEALTH SERVICES PTE LTD. (SG) 2014-11-27 — — 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 (2 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-20190002429-A1 Derivatives of Xanthone Compounds XDH, XPA, SQLE HPGD 208/4885NPY4R 1057/4885NPY1R 927/4885
US-20140349918-A1 DERIVATIVES OF XANTHONE COMPOUNDS XDH, XPA, SQLE HPGD 208/4885NPY4R 1057/4885NPY1R 927/4885

“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.

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