SCHEMBL3904681

SCHEMBL3904681

COC(=O)C1(c2ccc(N)cc2)CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.52
ALDH1A1 P00352 3/20 0.46
POLB P06746 3/20 0.45
CYP2C19 P33261 5/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP2C9 P11712 3/20 0.43
CYP3A4 P08684 2/20 0.43
HRH3 Q9Y5N1 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.41
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL1465475 0.89 POLB (0.42) HDAC1ALDH1A1POLBLMNAMEN1
SCHEMBL23164033 0.86 ALDH1A1 (0.47) HDAC1ALDH1A1POLBCYP2C19LMNA
SCHEMBL16897444 0.86 CYP2C19 (0.57) ALDH1A1POLBCYP2C19LMNATSHR
SCHEMBL2267755 0.85 HRH3 (0.43) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL2268465 0.85 HRH3 (0.46) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL16477203 0.84 ALDH1A1 (0.46) HDAC1ALDH1A1POLBCYP2C19LMNA
SCHEMBL1121038 0.84 HDAC1 (0.53) HDAC1ALDH1A1POLBCYP2C19LMNA
SCHEMBL23163730 0.84 ALDH1A1 (0.62) ALDH1A1POLBCYP2C19LMNAMEN1
SCHEMBL1626631 0.84 ALDH1A1 (0.61) HDAC1ALDH1A1CYP2C19LMNATSHR
SCHEMBL22992467 0.84 OPRM1 (0.52) ALDH1A1POLBCYP2C19LMNATSHR

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 14 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
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 HDAC1 1847/4885ALDH1A1 4702/4885POLB 3762/4885
US-20070249680-A1 INHIBITORS OF C-FMS KINASE MUSK, FRK, FES HDAC1 1847/4885ALDH1A1 4702/4885POLB 3762/4885

“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.