SCHEMBL3652525

SCHEMBL3652525

CN(Cc1cn(-c2ccccc2)nn1)C1CCCc2cccnc21

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 20/20 0.58
KCNH2 Q12809 1/20 0.53

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
SCHEMBL15081706 0.88 CXCR4 (0.54) CXCR4KCNH2
SCHEMBL13669508 0.87 CXCR4 (0.54) CXCR4KCNH2
SCHEMBL15081704 0.86 CXCR4 (0.53) CXCR4KCNH2
SCHEMBL3658508 0.85 CXCR4 (0.52) CXCR4KCNH2
SCHEMBL13509647 0.85 CXCR4 (0.55) CXCR4KCNH2
SCHEMBL13509895 0.84 CXCR4 (0.51) CXCR4KCNH2
Hydrochloric Acid SCHEMBL3803554 0.84 CXCR4 (0.51) CXCR4KCNH2
SCHEMBL15082030 0.84 CXCR4 (0.58) CXCR4
SCHEMBL15081708 0.82 CXCR4 (0.49) CXCR4KCNH2
SCHEMBL13509859 0.82 CXCR4 (0.71) CXCR4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9314468-B2 Chemokine receptor modulators ALTIRIS THERAPEUTICS, INC. (US) 2016-04-19 US disclosed
US-9314468-B2 Chemokine receptor modulators ALTIRIS THERAPEUTICS, INC. (US) 2016-04-19 US disclosed
US-9314468-B2 Chemokine receptor modulators ALTIRIS THERAPEUTICS, INC. (US) 2016-04-19 US disclosed
EP-2664618-A2 Chemokine receptor modulators Altiris Therapeutics (US) 2013-11-20 EP disclosed
EP-2262808-B1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2013-08-14 EP disclosed
EP-2262808-B1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2013-08-14 EP disclosed
US-20130172330-A1 Chemokine Receptor Modulators ALTIRIS THERAPEUTICS, INC. (US) 2013-07-04 US disclosed
US-20130172330-A1 Chemokine Receptor Modulators ALTIRIS THERAPEUTICS, INC. (US) 2013-07-04 US disclosed
US-20130172330-A1 Chemokine Receptor Modulators ALTIRIS THERAPEUTICS, INC. (US) 2013-07-04 US disclosed
US-8338448-B2 Chemokine receptor modulators ALTIRIS THERAPEUTICS, INC. (US) 2012-12-25 US disclosed
US-8338448-B2 Chemokine receptor modulators ALTIRIS THERAPEUTICS, INC. (US) 2012-12-25 US disclosed
US-8338448-B2 Chemokine receptor modulators ALTIRIS THERAPEUTICS, INC. (US) 2012-12-25 US disclosed
EP-2262808-A2 CHEMOKINE RECEPTOR MODULATORS Altiris Therapeutics (US) 2010-12-22 EP disclosed
US-20100029634-A1 Chemokine Receptor Modulators ALTIRIS THERAPEUTICS, INC. 2010-02-04 US disclosed
US-20100029634-A1 Chemokine Receptor Modulators ALTIRIS THERAPEUTICS, INC. 2010-02-04 US disclosed
US-20100029634-A1 Chemokine Receptor Modulators ALTIRIS THERAPEUTICS, INC. 2010-02-04 US disclosed
WO-2009121063-A2 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2009-10-01 WO disclosed
WO-2009121063-A2 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2009-10-01 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 (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-20130172330-A1 Chemokine Receptor Modulators CCR5, CXCR4, ACKR3 CXCR4 2/4885KCNH2 4846/4885
US-20100029634-A1 Chemokine Receptor Modulators CCR5, CXCR4, ACKR3 CXCR4 2/4885KCNH2 4846/4885

“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.