SCHEMBL2827320

SCHEMBL2827320

Cn1cc(OC(=O)O)nn1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ KDM5C P41229 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM2A Q9Y2K7 1/20 0.33
▸ KDM3A Q9Y4C1 1/20 0.33
▸ BRD4 O60885 2/20 0.31

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
SCHEMBL28381822 0.84 KDM4E (0.33) KDM4EKDM4AKDM5CKDM4CKDM2A
SCHEMBL5010286 0.75 — —
SCHEMBL25005776 0.74 ELANE (0.32) —
SCHEMBL3105704 0.72 — —
SCHEMBL25005850 0.70 ELANE (0.38) —
SCHEMBL835251 0.68 — —
SCHEMBL28574232 0.68 NPC1 (0.30) —
SCHEMBL4691162 0.68 TSHR (0.41) KDM4E
SCHEMBL2145290 0.68 CPB2 (0.35) —
SCHEMBL3581966 0.67 — —

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
EP-2401256-B1 Compounds as bradykinin B1 antagonists BOEHRINGER INGELHEIM INT (DE) 2013-04-17 — — EP disclosed
WO-2010097372-A1 COMPOUNDS AS BRADYKININ B1 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 — — WO disclosed
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