SCHEMBL3903075

SCHEMBL3903075

COC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
HDAC1 Q13547 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
HTR1E P28566 1/20 0.47
S1PR3 Q99500 1/20 0.47
ADRA1D P25100 4/20 0.47
ADRA1A P35348 4/20 0.47
ADRA1B P35368 3/20 0.47
MAPK1 P28482 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
SCHEMBL1465773 0.90 MEN1 (0.54) L3MBTL1HDAC1MEN1CYP1A2CYP2C19
SCHEMBL3227451 0.87 MEN1 (0.58) L3MBTL1MEN1CYP1A2CYP2C19KMT2A
SCHEMBL16423615 0.85 LMNA (0.58) L3MBTL1HDAC1SMN1; SMN2MEN1CYP1A2
SCHEMBL16423511 0.83 L3MBTL1 (0.65) L3MBTL1HDAC1SMN1; SMN2MEN1CYP1A2
SCHEMBL3904809 0.82 L3MBTL1 (0.64) L3MBTL1HDAC1SMN1; SMN2MEN1CYP1A2
SCHEMBL23164033 0.81 ALDH1A1 (0.47) HDAC1MEN1CYP2C19KMT2ALMNA
SCHEMBL16897444 0.81 CYP2C19 (0.57) SMN1; SMN2MEN1CYP2C19KMT2ALMNA
SCHEMBL20588981 0.81 SMN1; SMN2 (0.50) L3MBTL1HDAC1SMN1; SMN2MEN1KMT2A
SCHEMBL28625648 0.81 L3MBTL1 (0.55) L3MBTL1HDAC1SMN1; SMN2MEN1CYP1A2
SCHEMBL23163730 0.80 ALDH1A1 (0.62) L3MBTL1SMN1; SMN2MEN1CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394289-B2 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2016-07-19 US disclosed
US-9394289-B2 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2016-07-19 US disclosed
EP-2016070-B1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA NV (BE) 2016-01-13 EP disclosed
EP-2016070-B1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA NV (BE) 2016-01-13 EP disclosed
US-20140378457-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA NV (BE) 2014-12-25 US disclosed
US-20140378457-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA NV (BE) 2014-12-25 US disclosed
US-8859602-B2 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2014-10-14 US disclosed
US-8859602-B2 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2014-10-14 US disclosed
US-8859602-B2 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2014-10-14 US disclosed
EP-2016070-A1 INHIBITORS OF C-FMS KINASE Janssen Pharmaceutica, N.V. (BE) 2009-01-21 EP disclosed
WO-2007124319-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-01 WO disclosed
WO-2007124319-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-01 WO disclosed
US-20070249680-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2007-10-25 US disclosed
US-20070249680-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2007-10-25 US disclosed
US-20070249680-A1 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2007-10-25 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 (2 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-20140378457-A1 INHIBITORS OF C-FMS KINASE MUSK, FRK, FES L3MBTL1 1001/4885HDAC1 1847/4885SMN1; SMN2 2358/4885
US-20070249680-A1 INHIBITORS OF C-FMS KINASE MUSK, FRK, FES L3MBTL1 1001/4885HDAC1 1847/4885SMN1; SMN2 2358/4885

“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.