SCHEMBL7835602

SCHEMBL7835602

Clc1ccc(Oc2cc(-c3cccs3)nc3c(Br)cnn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 3/20 0.48
▸ CSNK2A1 P68400 2/20 0.41
▸ KDM4E B2RXH2 5/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ MAPT P10636 5/20 0.37
▸ PPARG P37231 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NCOA2 Q15596 1/20 0.37
▸ NCOA1 Q15788 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ NCOA3 Q9Y6Q9 1/20 0.37
▸ CDK2 P24941 2/20 0.36
▸ CHEK1 O14757 1/20 0.36
▸ CCNA2 P20248 1/20 0.36
▸ CCNA1 P78396 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ LMNA P02545 2/20 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
SCHEMBL12953165 0.80 GSK3B (0.59) GSK3BCSNK2A1KDM4EALDH1A1HPGD
SCHEMBL7830317 0.78 GSK3B (0.48) GSK3BKDM4EALDH1A1HPGDMAPT
SCHEMBL7835008 0.75 GSK3B (0.57) GSK3BCSNK2A1CDK2
SCHEMBL13993123 0.75 CSNK2A1 (0.67) GSK3BCSNK2A1KDM4EALDH1A1HPGD
SCHEMBL6029404 0.72 KDM4E (0.61) GSK3BCSNK2A1KDM4EALDH1A1HPGD
SCHEMBL7832777 0.68 GSK3B (0.50) GSK3BKDM4EALDH1A1HPGDMAPT
SCHEMBL7835695 0.67 GSK3B (0.48) GSK3BKDM4EALDH1A1HPGDMAPT
SCHEMBL13998521 0.67 GSK3B (0.70) GSK3BCSNK2A1KDM4EALDH1A1HPGD
SCHEMBL20186414 0.66 MAPT (0.46) GSK3BCSNK2A1KDM4EALDH1A1HPGD
SCHEMBL13305017 0.65 CSNK2A1 (0.48) GSK3BCSNK2A1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820997-B1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2001-07-25 — — EP disclosed
US-5985882-A ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 — — US disclosed
EP-0820997-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-01-28 — — EP disclosed
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