SCHEMBL389069

SCHEMBL389069

CC(C)(C)OC(=O)NC1CCN(c2ccc(Br)cn2)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.53
▸ CKS1B P61024 1/20 0.53
▸ SKP1 P63208 1/20 0.53
▸ SKP2 Q13309 1/20 0.53
▸ MAP4K4 O95819 2/20 0.52
▸ JAK3 P52333 1/20 0.51
▸ BTK Q06187 1/20 0.51
▸ SUV39H2 Q9H5I1 6/20 0.51
▸ PDE10A Q9Y233 2/20 0.51
▸ RET P07949 1/20 0.47
▸ TRPV1 Q8NER1 2/20 0.47
▸ TRPM8 Q7Z2W7 1/20 0.47
▸ CTSK P43235 2/20 0.46

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
SCHEMBL390147 1.00 SYK (0.53) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL389068 1.00 SYK (0.53) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL31270899 0.94 MAP4K4 (0.60) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL3025692 0.93 CKS1B (0.60) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL31370459 0.91 PDE10A (0.50) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL529863 0.88 MAP4K4 (0.58) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL594137 0.88 MAP4K4 (0.58) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL596151 0.88 MAP4K4 (0.58) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL14196275 0.87 SYK (0.53) SYKCKS1BSKP1SKP2MAP4K4
SCHEMBL22826263 0.87 SYK (0.53) SYKCKS1BSKP1SKP2MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101764-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2012-01-24 — — US disclosed
US-8063078-B2 Urea-compounds active as vanilloid receptor antagonists for the treatment of pain GLAXOSMITHKLINE LLC (US) 2011-11-22 — — US disclosed
EP-2298757-A2 Urea compounds active as vanilloid receptor antagonist for the treatment of pain Glaxo Group Limited (GB) 2011-03-23 — — EP disclosed
US-7867980-B2 Lincosamide derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-11 — — US disclosed
US-20100184746-A1 LINCOSAMIDE DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD 2010-07-22 — — US disclosed
EP-2166015-A1 LINCOSAMIDE DERIVATIVE, AND ANTIBACTERIAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT Meiji Seika Kaisha Ltd. (JP) 2010-03-24 — — EP disclosed
US-20100016350-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2010-01-21 — — US disclosed
US-20090163506-A1 Urea-compounds active as vanilloid receptor antagonists for the treatment of pain SMITHKLINE BEECHAM PLC. (GB) 2009-06-25 — — US disclosed
EP-2036902-A2 Urea compounds active as vanilloid receptor antagonist for the treatment of pain Glaxo Group Limited (GB) 2009-03-18 — — EP disclosed
EP-2029610-A2 NOVEL MCH RECEPTOR ANTAGONISTS Eli Lilly & Company (US) 2009-03-04 — — EP disclosed
WO-2007146759-A2 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-12-21 — — WO 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 (3 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-20100016350-A1 NOVEL MCH RECEPTOR ANTAGONISTS MCHR1, MCHR2, MC1R SYK 2493/4885CKS1B 3179/4885SKP1 1591/4885
US-20090163506-A1 Urea-compounds active as vanilloid receptor antagonists for the treatment of pain TRPV1, OPRL1, UTS2R SYK 3272/4885CKS1B 2175/4885SKP1 1221/4885
US-20100184746-A1 LINCOSAMIDE DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT SIRT6, LAS1L, MRPS18A SYK 4544/4885CKS1B 1568/4885SKP1 2353/4885

“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.

Send feedback