SCHEMBL5530804

SCHEMBL5530804

ONC(=Nc1cccc(Cl)c1)N1CCN(c2ccccn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.58
HSD17B10 Q99714 3/20 0.51
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
BACE1 P56817 1/20 0.49
KDM4E B2RXH2 8/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
EPHX2 P34913 1/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
MAPT P10636 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HPGD P15428 2/20 0.46
GAA P10253 1/20 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
SCHEMBL5531051 0.80 HTR3E (0.47) ALDH1A1KMT2AMEN1LMNAMAPT
SCHEMBL5530801 0.78 ALDH1A1 (0.57) ALDH1A1HSD17B10KDM4ESMN1; SMN2EPHX2
SCHEMBL5530797 0.78 ALDH1A1 (0.57) ALDH1A1HSD17B10KDM4ESMN1; SMN2EPHX2
SCHEMBL5527790 0.76 GAA (0.60) ALDH1A1HSD17B10SMN1; SMN2KMT2ALMNA
SCHEMBL5524871 0.75 MAPT (0.53) ALDH1A1HSD17B10SMN1; SMN2KMT2AMEN1
SCHEMBL14448355 0.73 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL5527844 0.71 ALDH1A1 (0.56) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL3578857 0.69 SLC6A7 (0.78) ALDH1A1HSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL5481399 0.69 KDM4E (0.77) ALDH1A1HSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL5481404 0.69 KDM4E (0.77) ALDH1A1HSD17B10KDM4ESMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070203140-A1 N-hydroxyguanidines as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION 2007-08-30 US claimed
WO-2007095050-A2 N-HYDROXYGUANIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2007-08-23 WO claimed
US-20070203140-A1 N-hydroxyguanidines as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION 2007-08-30 US 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-20070203140-A1 N-hydroxyguanidines as modulators of indoleamine 2,3-dioxygenase IDO1, IDO2, HNMT ALDH1A1 764/4885HSD17B10 685/4885BCHE 264/4885

“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.