SCHEMBL1179567

SCHEMBL1179567

Fc1c(Cl)cccc1CNC1=NCCO1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CFB P00751 1/20 0.39
P2RX7 Q99572 6/20 0.38
CD38 P28907 1/20 0.38
CFD P00746 3/20 0.35
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
EGFR P00533 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
MAP4K1 Q92918 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ADRA1A P35348 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
SCHEMBL1178307 0.86 CYP2A13 (0.43) CFBP2RX7POLB
SCHEMBL1178958 0.85 GAA (0.46) CFBTP53POLBGAATSHR
SCHEMBL10014958 0.83 TAAR1 (0.45) CFBTP53GAATAAR1ADRA2A
SCHEMBL8348698 0.83 TAAR1 (0.34) CFBTAAR1ADRA2AADRA2BADRA2C
SCHEMBL1178173 0.78 CD38 (0.36) CFBP2RX7CD38MAP4K1ADRA2A
SCHEMBL1178947 0.77 P2RX7 (0.45) P2RX7
SCHEMBL14213775 0.76 P2RX7 (0.38) CFBP2RX7
SCHEMBL1178520 0.74 TAAR1 (0.47) CFBP2RX7CD38TP53GAA
SCHEMBL3411857 0.74 CFB (0.36) CFBP2RX7CFDTAAR1MAP4K1
SCHEMBL1179180 0.74 CYP2A13 (0.41) CFBPOLBEGFRADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10251865-B2 Method of activating regulatory T cells with alpha-2B adrenergic receptor agonists ALLERGAN, INC. (US) 2019-04-09 US disclosed
EP-3332782-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. (US) 2018-06-13 EP disclosed
US-20180071259-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. 2018-03-15 US disclosed
US-20180071259-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. 2018-03-15 US disclosed
US-20170079956-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. 2017-03-23 US disclosed
US-20170079956-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. 2017-03-23 US disclosed
US-9545394-B2 Method of activating regulatory T cells with alpha-2B adrenergic receptor agonists ALLERGAN, INC. (US) 2017-01-17 US disclosed
US-9545394-B2 Method of activating regulatory T cells with alpha-2B adrenergic receptor agonists ALLERGAN, INC. (US) 2017-01-17 US disclosed
US-20160158199-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. 2016-06-09 US disclosed
US-20160158199-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC. 2016-06-09 US disclosed
US-20120041031-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ALLERGAN, INC (US) 2012-02-16 US disclosed
EP-2351561-A2 Novel methods and compositions for alleviating pain Allergan, Inc. (US) 2011-08-03 EP disclosed
US-20110028523-A1 Selective Alpha 2B/2C Agonists ALLERGAN, INC. (US) 2011-02-03 US disclosed
US-20110028523-A1 Selective Alpha 2B/2C Agonists ALLERGAN, INC. (US) 2011-02-03 US disclosed
US-20110028523-A1 Selective Alpha 2B/2C Agonists ALLERGAN, INC. (US) 2011-02-03 US disclosed
WO-2011014332-A1 SELECTIVE ALPHA 2B/2C AGONISTS ALLERGAN, INC. (US) 2011-02-03 WO disclosed
WO-2011014332-A1 SELECTIVE ALPHA 2B/2C AGONISTS ALLERGAN, INC. (US) 2011-02-03 WO disclosed
US-7345065-B2 Methods and compositions for alleviating pain ALLERGAN, INC. (US) 2008-03-18 US disclosed
US-7345065-B2 Methods and compositions for alleviating pain ALLERGAN, INC. (US) 2008-03-18 US disclosed
WO-2003099289-A2 COMPOSITIONS AND THEIR USES FOR ALLEVIATING PAIN ALLERGAN, INC. (US) 2003-12-04 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 (6 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-20120041031-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ADRA2B, ADRB2, ADRA2A CFB 2236/4885P2RX7 291/4885CD38 874/4885
US-20180071259-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ADRA2B, ADRB2, ADRA2A CFB 2333/4885P2RX7 305/4885CD38 872/4885
US-20110028523-A1 Selective Alpha 2B/2C Agonists ADRA2C, ADRA2B, ADRB2 CFB 3527/4885P2RX7 123/4885CD38 1384/4885
US-20160158199-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ADRA2B, ADRB2, ADRA2A CFB 2333/4885P2RX7 305/4885CD38 872/4885
US-20170079956-A1 METHOD OF ACTIVATING REGULATORY T CELLS WITH ALPHA-2B ADRENERGIC RECEPTOR AGONISTS ADRA2B, ADRB2, ADRA2A CFB 2261/4885P2RX7 301/4885CD38 888/4885
US-10251865-B2 Method of activating regulatory T cells with alpha-2B adrenergic receptor agonists ADRA2B, ADRB2, ADRA2A CFB 2333/4885P2RX7 305/4885CD38 872/4885

“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.