Sitokiren

Sitokiren

SCHEMBL19512247

COC(=O)NCCCn1nc(C(C)N(C(=O)C2CNCCO2)C2CC2)c2ccc(C)nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

REN

The experimentally established mechanism targets of Sitokiren. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN known ✓ P00797 20/20 1.00

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
Sitokiren SCHEMBL16471589 1.00 REN (1.00) REN
Sitokiren SCHEMBL16471588 1.00 REN (1.00) REN
Sitokiren SCHEMBL26960855 1.00 REN (1.00) REN
Sitokiren SCHEMBL29492575 1.00 REN (1.00) REN
Sitokiren SCHEMBL19512224 1.00 REN (1.00) REN
SCHEMBL17012941 0.94 REN (0.89) REN
SCHEMBL15418065 0.94 REN (0.88) REN
SCHEMBL20548988 0.94 REN (0.88) REN
SCHEMBL19512220 0.94 REN (0.88) REN
SCHEMBL17550610 0.94 REN (0.88) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687518-B1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2017-11-01 — — EP claimed
EP-4209218-A1 APPLICATION OF NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-12 — — EP disclosed
WO-2022048618-A1 METHODS TO TREAT INFLAMMATORY BOWEL DISEASE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2022-03-10 — — WO disclosed
WO-2022047730-A1 METHODS TO TREAT INFLAMMATORY BOWEL DISEASE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2022-03-10 — — WO disclosed
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