SCHEMBL3352306

SCHEMBL3352306

OC1(C(F)(F)F)CCN(CCCCl)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.37
DRD2 P14416 7/20 0.36
HTR1A P08908 4/20 0.36
HTR2A P28223 4/20 0.36
HTR7 P34969 4/20 0.36
DRD1 P21728 3/20 0.36
DRD5 P21918 3/20 0.36
SLC6A2 P23975 3/20 0.36
SLC6A4 P31645 3/20 0.36
DRD3 P35462 3/20 0.36
HTR2B P41595 3/20 0.36
HRH1 P35367 3/20 0.36
CCR5 P51681 1/20 0.36
CCR1 P32246 1/20 0.33
HRH3 Q9Y5N1 5/20 0.33
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
S1PR5 Q9H228 1/20 0.32
DRD4 P21917 2/20 0.32
HRH2 P25021 2/20 0.32

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
SCHEMBL3293743 0.89 MCHR1 (0.36) MCHR1CCR5
SCHEMBL14393894 0.77 KDM4E (0.39) MCHR1DRD2CCR5S1PR1S1PR3
SCHEMBL3298160 0.75 S1PR1 (0.38) DRD2HTR1AHTR2AHTR7DRD1
SCHEMBL13656277 0.74 KCNH2 (0.39) MCHR1CCR5OPRM1
SCHEMBL27986834 0.74 HRH3 (0.46) DRD2HTR1AHTR2AHTR7DRD1
Hydrochloric Acid SCHEMBL4363063 0.72 HRH3 (0.45) DRD2HTR1AHTR2AHTR7DRD1
SCHEMBL14155728 0.72 KDM4E (0.36) CCR5OPRM1OPRK1OPRD1
SCHEMBL13660266 0.70 MCHR1 (0.38) MCHR1DRD2CCR5
SCHEMBL23853043 0.70 HRH3 (0.43) HRH3SIGMAR1
SCHEMBL3412350 0.70

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090075986-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-03-19 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
EP-1773784-A2 ANTI-INFLAMMATORY MEDICAMENTS Deciphera Pharmaceuticals, LLC (US) 2007-04-18 EP disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 US disclosed
WO-2006014290-A2 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-02-09 WO disclosed
US-20050288286-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2005-12-29 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 (5 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-20090105230-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MCHR1 4333/4885DRD2 4379/4885HTR1A 2439/4885
US-20090075986-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MCHR1 4333/4885DRD2 4379/4885HTR1A 2439/4885
US-20070037808-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 MCHR1 3911/4885DRD2 4605/4885HTR1A 2506/4885
US-20050288286-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MCHR1 4333/4885DRD2 4379/4885HTR1A 2439/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 MCHR1 3911/4885DRD2 4605/4885HTR1A 2506/4885

“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.