SCHEMBL3952822

SCHEMBL3952822

O=C(O)N1CCN(c2ccncc2[N+](=O)[O-])CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.48
▸ MAPT P10636 9/20 0.48
▸ HTT P42858 4/20 0.48
▸ LMNA P02545 2/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ GRM5 P41594 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ FAAH O00519 1/20 0.43
▸ MGLL Q99685 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ RECQL P46063 1/20 0.42

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
SCHEMBL13736235 1.00 KMT2A (0.48) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL16505318 0.95 MAPT (0.50) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL16505317 0.95 MAPT (0.50) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL2849150 0.82 MAPT (0.58) KMT2AMAPTLMNAMAPK1ALDH1A1
SCHEMBL9257335 0.82 MAPT (0.65) KMT2AMAPTHTTLMNAALDH1A1
SCHEMBL9425659 0.82 MAPT (0.67) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL15771279 0.81 CYP3A4 (0.52) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL1710516 0.81 MAPT (0.65) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL4526192 0.80 GRM5 (0.67) KMT2AMAPTHTTLMNAMAPK1
SCHEMBL9261808 0.80 KMT2A (0.47) KMT2AMAPTHTTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727932-A1 SMALL MOLECULE LIGANDS AND APTAMERS MeiraGTx Gene Regulation Limited (GB) 2026-04-22 — — EP disclosed
WO-2024256870-A1 SMALL MOLECULE LIGANDS AND APTAMERS MEIRAGTX UK II LIMITED (GB) 2024-12-19 — — WO disclosed
EP-2702063-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2014-03-05 — — EP disclosed
WO-2012148775-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-11-01 — — WO disclosed
EP-2078004-A1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2009-07-15 — — EP disclosed
WO-2008054749-A1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2008-05-08 — — WO disclosed
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