SCHEMBL5755975

SCHEMBL5755975

NC(=O)N1CCCC1C(=O)Oc1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FKBP1A P62942 6/20 0.41
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.39
PKM P14618 1/20 0.38
DPP4 P27487 1/20 0.38
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
CPT2 P23786 1/20 0.37
CPT1A P50416 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
SPHK2 Q9NRA0 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36

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
SCHEMBL6982186 0.79 FURIN (0.42) PKMDPP4HCRTR1HCRTR2
SCHEMBL6417173 0.73 KMT2A (0.57) ALDH1A1SMN1; SMN2MAPK1
SCHEMBL20558297 0.73 KMT2A (0.46) SMN1; SMN2NPC1HTTPKM
SCHEMBL28737837 0.72 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2HTTPKM
SCHEMBL38659451 0.71 HSD11B1 (0.51) ALDH1A1NPC1DPP4CPT1AMAPK1
SCHEMBL8296762 0.71 HSD11B1 (0.51) ALDH1A1NPC1DPP4CPT1AMAPK1
Oxamate SCHEMBL11859373 0.71 LMNA (0.40) ALDH1A1SMN1; SMN2NPC1PKMKDM4E
SCHEMBL29806270 0.71 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2HCRTR1HCRTR2CPT2
SCHEMBL1219412 0.70 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2FKBP1ANPC1DPP4
SCHEMBL3785957 0.69 EPHX2 (0.44) ALDH1A1SMN1; SMN2NPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7148242-B2 N-formyl hydroxylamine compounds, compositions and methods of use NOVARTIS AG (CH) 2006-12-12 US disclosed
EP-1401828-B1 N-FORMYL HYDROXYLAMINE COMPOUNDS AS INHIBITORS OF PDF VICURON PHARM INC (US) 2006-04-12 EP disclosed
EP-1401828-A1 N-FORMYL HYDROXYLAMINE COMPOUNDS AS INHIBITORS OF PDF Vicuron Pharmaceuticals, Inc. (US) 2004-03-31 EP disclosed
US-20030045479-A1 Novel N-formyl hydroxylamine compounds, compositions and methods of use VICURON HOLDINGS LLC 2003-03-06 US disclosed
WO-2002102790-A1 N-FORMYL HYDROXYLAMINE COMPOUNDS AS INHIBITORS OF PDF VICURON PHARMACEUTICALS INC. (US) 2002-12-27 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-20030045479-A1 Novel N-formyl hydroxylamine compounds, compositions and methods of use PDF, HNMT, AADAC ALDH1A1 2056/4885SMN1; SMN2 2375/4885FKBP1A 1874/4885

“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.