SCHEMBL3087967

SCHEMBL3087967

CN(Cc1ccc(N)cc1)CC1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.43
CSF1R P07333 9/20 0.43
CXCR3 P49682 2/20 0.36
MAPT P10636 1/20 0.36
RORC P51449 1/20 0.35
LSS P48449 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.34
EZH2 Q15910 1/20 0.33

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
SCHEMBL4267535 0.89 CXCR3 (0.41) CXCR3MAPTLSSTAS2R14
SCHEMBL24085875 0.84 PYCR1 (0.45) HTTCSF1RCXCR3TAS2R14
SCHEMBL1191857 0.84 HTT (0.54) HTTCSF1R
SCHEMBL9310257 0.81 MAPT (0.46) HTTMAPTRORCLSS
Hydrochloric Acid SCHEMBL6340964 0.79 HRH3 (0.50) MAPT
Hydrochloric Acid SCHEMBL7221627 0.79 HRH3 (0.50) MAPT
SCHEMBL3088232 0.79 PYCR1 (0.51) HTTCSF1RMAPT
SCHEMBL3158453 0.78 CXCR3 (0.38) CXCR3MAPTLSS
SCHEMBL313877 0.78 HRH3 (0.51) MAPT
SCHEMBL3190543 0.76 GAA (0.45) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765803-B1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2016-03-09 EP disclosed
US-7799824-B2 Quaternary salt CCR2 antagonists ORAPHARMA, INC. (US) 2010-09-21 US disclosed
US-7799824-B2 Quaternary salt CCR2 antagonists ORAPHARMA, INC. (US) 2010-09-21 US disclosed
US-7799824-B2 Quaternary salt CCR2 antagonists ORAPHARMA, INC. (US) 2010-09-21 US disclosed
EP-1765803-A1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-28 EP disclosed
US-20060293379-A1 Quaternary salt CCR2 antagonists KENVUE BRANDS LLC 2006-12-28 US disclosed
WO-2006012135-A1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA, N. V. (BE) 2006-02-02 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-20060293379-A1 Quaternary salt CCR2 antagonists CCR2, CCR1, CXCR2 HTT 1992/4885CSF1R 36/4885CXCR3 11/4885

“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.