SCHEMBL5886482

SCHEMBL5886482

CCOC(=O)c1nnc(Cl)cc1N(CC)CC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
GLP1R P43220 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 7/20 0.39
NPSR1 Q6W5P4 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
NPC1 O15118 2/20 0.39
TP53 P04637 1/20 0.39
XBP1 P17861 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
TLR9 Q9NR96 1/20 0.39
GAA P10253 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
TARBP2 Q15633 1/20 0.38
RAB9A P51151 1/20 0.37
CASP1 P29466 1/20 0.37

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
SCHEMBL29739916 0.79 GLP1R (0.49) GLP1RL3MBTL1MAPTNPSR1ALDH1A1
SCHEMBL4019772 0.79 GLP1R (0.49) GLP1RL3MBTL1MAPTNPSR1ALDH1A1
SCHEMBL25771606 0.78 TSHR (0.47) KDM4EGLP1RL3MBTL1MAPTNPSR1
SCHEMBL23618033 0.78 NR1H2 (0.47) KDM4EGLP1RL3MBTL1MAPTNPSR1
SCHEMBL5886537 0.75 MAPT (0.43) KDM4EGLP1RL3MBTL1MAPTNPSR1
SCHEMBL26663215 0.75 ALDH1A1 (0.37) KDM4EL3MBTL1NPSR1ALDH1A1
SCHEMBL15112580 0.73 MAPT (0.39) KDM4EGLP1RL3MBTL1MAPTNPSR1
SCHEMBL31208503 0.72 MAPT (0.40) GLP1RL3MBTL1MAPTNPSR1ALDH1A1
SCHEMBL4041010 0.72 ALDH1A1 (0.45) KDM4EGLP1RL3MBTL1MAPTNPSR1
SCHEMBL6197913 0.71 MAPT (0.40) KDM4EGLP1RL3MBTL1MAPTNPSR1

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
US-7122546-B2 Imidazol-1-ylmethyl pyridazine derivatives NEUROGEN CORPORATION (US) 2006-10-17 US disclosed
EP-1549636-A1 IMIDAZOL-1-YLMETHYL PYRIDAZINE DERIVATIVES Neurogen Corporation (US) 2005-07-06 EP disclosed
US-20040077653-A1 Imidazol-1-ylmethyl pyridazine derivatives NEUROGEN CORPORATION 2004-04-22 US disclosed
WO-2004031174-A1 IMIDAZOL-1-YLMETHYL PYRIDAZINE DERIVATIVES NEUROGEN CORPORATION (US) 2004-04-15 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 (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-20040077653-A1 Imidazol-1-ylmethyl pyridazine derivatives GABRA5, GABRA1, GABRA2 KDM4E 2698/4885GLP1R 537/4885L3MBTL1 2983/4885

“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.