SCHEMBL2801510

SCHEMBL2801510

CCS(=O)(=O)NC(=O)c1cnn2c(Nc3ccccc3O)c(C(=O)N3CCC(c4ccccc4)CC3)cnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 5/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
SPR P35270 4/20 0.37
SIRT5 Q9NXA8 1/20 0.37
ALDH1A1 P00352 2/20 0.36
FASN P49327 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCD5 Q86SK9 1/20 0.35
PIM1 P11309 1/20 0.35
AKT1 P31749 1/20 0.35
GSK3A P49840 1/20 0.35
PIM3 Q86V86 1/20 0.35
OPRM1 P35372 1/20 0.34
F11 P03951 1/20 0.34
PDE4B Q07343 1/20 0.34

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
SCHEMBL2803213 0.92 NPC1 (0.40) CA12CA1CA2CA7CA9
SCHEMBL2800478 0.91 SIRT5 (0.46) EGLN1SPRSIRT5ALDH1A1FASN
SCHEMBL2798787 0.91 TNF (0.36) EGLN1CA12CA1CA2CA7
SCHEMBL2803776 0.91 SPR (0.38) CA12CA1CA2CA7CA9
SCHEMBL2802343 0.91 JAK2 (0.38) EGLN1CA12CA1CA2CA7
SCHEMBL2802383 0.90 HPGD (0.45) ALDH1A1L3MBTL1PIM1
SCHEMBL2798793 0.89 SPR (0.41) EGLN1CA12CA1CA2CA7
SCHEMBL2801637 0.89 SIRT5 (0.41) EGLN1SPRSIRT5ALDH1A1FASN
SCHEMBL2800861 0.88 TP53 (0.39) SPRALDH1A1FASNOPRM1F11
SCHEMBL2799384 0.88 NPC1 (0.38) EGLN1SPRSIRT5ALDH1A1FASN

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-8729264-B2 Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-05-20 US disclosed
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-10-07 US disclosed
EP-2206714-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES Kyowa Hakko Kirin Co., Ltd. (JP) 2010-07-14 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-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES TYR, CUTA, SERPINB1 EGLN1 1967/4885CA12 2287/4885CA1 4641/4885

“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.