SCHEMBL5097941

SCHEMBL5097941

CC(=O)N(C)c1ccc([N+](=O)[O-])c(N2CCCCC2)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.56
MAPT P10636 10/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
POLB P06746 3/20 0.53
LMNA P02545 2/20 0.53
MAPK1 P28482 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
GPR174 Q9BXC1 1/20 0.49
PKM P14618 2/20 0.48
GAA P10253 2/20 0.48
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL5104601 0.85 ALDH1A1 (0.62) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL3534751 0.83 ALDH1A1 (0.59) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL3537670 0.80 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL5098003 0.79 GAA (0.50) ALDH1A1MAPTL3MBTL1POLBLMNA
SCHEMBL7515290 0.78 MAPT (0.58) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL20623078 0.77 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL26482569 0.77 ALDH1A1 (0.61) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL7805753 0.76 MAPT (0.62) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL5104609 0.76 NPC1 (0.52) ALDH1A1MAPTL3MBTL1POLBSMN1; SMN2
SCHEMBL5098076 0.76 MAPT (0.62) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19

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-7427683-B2 c-fms kinase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2008-09-23 US disclosed
EP-1812425-A2 C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-01 EP disclosed
WO-2006047479-A2 C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-04 WO disclosed
US-20050131022-A1 C-fms kinase inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2005-06-16 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-20050131022-A1 C-fms kinase inhibitors FLT3, FES, FGR ALDH1A1 4568/4885MAPT 296/4885L3MBTL1 1019/4885

“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.