SCHEMBL1928236

SCHEMBL1928236

CC(C)N1CCC(Oc2c(F)cc(F)cc2Br)C1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.37
P2RX3 P56373 1/20 0.33
P2RX2 Q9UBL9 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ACACB O00763 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
SCHEMBL1928720 0.79 SLC6A4 (0.43) HRH3CNR1CNR2
SCHEMBL1928840 0.78 SCD (0.48) HRH3CNR1CNR2
SCHEMBL1927682 0.76 SCD (0.47) HRH3
SCHEMBL2932970 0.76 HRH3 (0.40) HRH3P2RX3P2RX2CNR1CNR2
SCHEMBL19767123 0.72 HRH3 (0.46) HRH3P2RX3P2RX2
SCHEMBL23993214 0.72 HRH3 (0.55) HRH3
SCHEMBL10057700 0.72 HRH3 (0.55) HRH3
SCHEMBL1928559 0.71 HRH3 (0.39) HRH3
SCHEMBL3589917 0.70 HRH3 (0.59) HRH3
SCHEMBL24224754 0.70 HTR2C (0.40) ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152234-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-06-23 US disclosed
US-7956084-B2 Phenyl thiophene carboxamide compounds as inhibitors of the enzyme IKK-2 ASTRAZENECA AB (SE) 2011-06-07 US disclosed
EP-1421074-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2010-09-29 EP disclosed
US-20070015819-A1 Novel compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2007-01-18 US disclosed
US-7125896-B2 Thiophene carboxamide compounds as inhibitors of enzyme IKK-2 ASTRAZENECA AB (SE) 2006-10-24 US disclosed
US-20040242573-A1 Novel compounds ASTRAZENECA AB (SE) 2004-12-02 US disclosed
EP-1421074-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2004-05-26 EP disclosed
WO-2003010158-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2003-02-06 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 (3 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-20070015819-A1 Novel compounds CNR1, ABCG2, CNR2 HRH3 159/4885P2RX3 101/4885P2RX2 104/4885
US-20040242573-A1 Novel compounds SULT1E1, TPMT, UGT1A1 HRH3 1028/4885P2RX3 242/4885P2RX2 321/4885
US-20110152234-A1 Novel Compounds CNR1, ABCG2, CNR2 HRH3 159/4885P2RX3 101/4885P2RX2 104/4885

“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.