SCHEMBL2722148

SCHEMBL2722148

CCSc1cc(C(OC2CCN(C)CC2)c2nc3ccccc3[nH]2)ccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MLKL Q8NB16 3/20 0.41
▸ DRD3 P35462 2/20 0.41
▸ HTR1A P08908 2/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ MAPK1 P28482 1/20 0.40
▸ HRH4 Q9H3N8 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 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
SCHEMBL2721841 0.85 DRD3 (0.45) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL15227704 0.85 MLKL (0.46) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL12474351 0.84 MLKL (0.45) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL2721601 0.84 MLKL (0.45) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL899887 0.81 MLKL (0.62) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL2720248 0.81 CHRM2 (0.50) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL2719928 0.80 CHRM2 (0.64) MLKLDRD3HTR1ACHRM2ADRA2A
Oxalic Acid SCHEMBL17491690 0.80 MAPT (0.43) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL2719856 0.80 DRD3 (0.49) MLKLDRD3HTR1ACHRM2ADRA2A
SCHEMBL15226943 0.79 DRD3 (0.38) MLKLDRD3HTR1ACHRM2ADRA2A

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-2621916-B1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2016-02-10 — — EP claimed
EP-2447263-A1 Benzazole derivatives as histamine H4 receptor ligands BIOPROJET (FR) 2012-05-02 — — EP claimed
EP-3378476-A1 H4 RECEPTOR INHIBITORS FOR TREATING TINNITUS Sensorion (FR) 2018-09-26 — — EP disclosed
US-9688989-B2 H4 receptor inhibitors for treating tinnitus SENSORION (FR) 2017-06-27 — — US disclosed
EP-2621916-B1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2016-02-10 — — EP disclosed
US-20150176010-A1 H4 RECEPTOR INHIBITORS FOR TREATING TINNITUS SENSORION (FR) 2015-06-25 — — US disclosed
EP-2447263-A1 Benzazole derivatives as histamine H4 receptor ligands BIOPROJET (FR) 2012-05-02 — — EP disclosed
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