SCHEMBL2720206

SCHEMBL2720206

CC(C)COc1cccc(C(NC2CCN(C)CC2)c2nc3ccccc3[nH]2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 2/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ DUT P33316 1/20 0.37
▸ HRH4 Q9H3N8 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ LMNA P02545 3/20 0.35
▸ SYK P43405 1/20 0.35

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
SCHEMBL2722101 0.91 DRD3 (0.43) DRD3DRD2HRH4MEN1KMT2A
SCHEMBL900249 0.91 MAPT (0.42) DRD3DRD2MAPTHRH4MEN1
SCHEMBL2720626 0.91 DRD3 (0.41) DRD3DRD2HRH4MEN1KMT2A
SCHEMBL2721839 0.90 DRD3 (0.43) DRD3DRD2MEN1KMT2AKCNH2
SCHEMBL2722268 0.89 DRD3 (0.42) DRD3DRD2MAPTHRH4MEN1
SCHEMBL2719981 0.89 PRMT5 (0.41) DRD3DRD2KCNH2SMN1; SMN2ALDH1A1
SCHEMBL2720512 0.89 DRD3 (0.42) DRD3DRD2MAPTMEN1POLB
SCHEMBL2721632 0.89 DRD3 (0.42) DRD3DRD2HRH4MEN1KMT2A
SCHEMBL2721765 0.88 PDE10A (0.42) DRD3DRD2HRH4MEN1KMT2A
SCHEMBL2720352 0.88 ALDH1A1 (0.44) DRD3DRD2HRH4POLBKCNH2

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 2 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 disclosed
EP-2447263-A1 Benzazole derivatives as histamine H4 receptor ligands BIOPROJET (FR) 2012-05-02 — — EP disclosed
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