SCHEMBL10565713

SCHEMBL10565713

CCCCNc1c(C(=O)O)cnc2cn[nH]c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM6B O15054 5/20 0.44
▸ KDM4C Q9H3R0 2/20 0.44
▸ HCAR3 P49019 2/20 0.42
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ KDM4A O75164 3/20 0.37
▸ KDM4D Q6B0I6 3/20 0.37
▸ KDM3B Q7LBC6 3/20 0.37
▸ HIF1AN Q9NWT6 3/20 0.37
▸ KDM5B Q9UGL1 3/20 0.37
▸ KDM2A Q9Y2K7 3/20 0.37
▸ MAPK8 P45983 1/20 0.37
▸ GABRP O00591 1/20 0.36
▸ GABRD O14764 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB1 P18505 1/20 0.36
▸ GABRG2 P18507 1/20 0.36
▸ GABRB3 P28472 1/20 0.36

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
SCHEMBL10566652 0.85 PDE4B (0.54) GAAMAPTPDE5APDE4BKDM4E
SCHEMBL10846042 0.82 PDE4B (0.51) GAAMAPTPDE5APDE4BKDM4E
SCHEMBL11786604 0.81 CCNE2 (0.48) KDM6BKDM4CHCAR3GAAMAPT
SCHEMBL10563817 0.80 CYP3A4 (0.38) HCAR3MAPTPDE5APDE4BCDK2
Acetic Acid SCHEMBL11790811 0.79 CCNE2 (0.47) KDM6BKDM4CHCAR3GAAMAPT
SCHEMBL10563794 0.78 HCAR3 (0.41) HCAR3KDM4EALDH1A1RAB9A
SCHEMBL2052464 0.72 MEN1 (0.57) HCAR3MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL13544631 0.70 KDM6B (0.33) KDM6BKDM4CKDM4AKDM4DKDM3B
SCHEMBL10567101 0.69 HPGD (0.37) HCAR3JAK2
SCHEMBL10570578 0.68 CYP1A2 (0.44) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4837238-A Pharmacologically useful pyrazolopyridines BEECHAM GROUP P.L.C. (GB) 1989-06-06 — — US disclosed
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