SCHEMBL4871769

SCHEMBL4871769

Cc1ccnc(NNC(=O)C(C2C[C@@H](C)C[C@@H](C)C2)N(O)C=O)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
NPC1 O15118 8/20 0.37
RAB9A P51151 8/20 0.37
SMN1; SMN2 Q16637 6/20 0.37
PKM P14618 3/20 0.37
MAPT P10636 1/20 0.36
TP53 P04637 2/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
FDPS P14324 1/20 0.34
RIOK2 Q9BVS4 3/20 0.34
GSK3A P49840 2/20 0.34
MAPK10 P53779 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL4863402 0.86 KDM4E (0.46) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL4868025 0.84 NPC1 (0.39) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL4872971 0.84 ALDH1A1 (0.39) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL4870936 0.76 GAA (0.41) MAPT
SCHEMBL1595621 0.75 SMN1; SMN2 (0.39) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL1595627 0.75 SMN1; SMN2 (0.39) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL1595625 0.75 SMN1; SMN2 (0.39) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL1595792 0.72 KMT2A (0.44) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL1595798 0.72 KMT2A (0.44) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL1595795 0.72 KMT2A (0.44) ALDH1A1LMNANPC1RAB9ASMN1; SMN2

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
US-7332485-B2 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP (US) 2008-02-19 US disclosed
US-20060160802-A1 Peptide deformylase inhibitors GLAXO GROUP LIMITED 2006-07-20 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-20060160802-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 ALDH1A1 4302/4885LMNA 2515/4885NPC1 1328/4885

“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.