SCHEMBL5585445

SCHEMBL5585445

O=C(O)c1ccc(Nc2nc(-c3cc(Cl)ccc3OCc3ccccc3)cs2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.58
PTGER1 P34995 9/20 0.58
CSNK2A1 P68400 8/20 0.56
AMY1A P0DUB6 1/20 0.56
TYR P14679 1/20 0.56
MEN1 O00255 1/20 0.54
NPC1 O15118 1/20 0.54
MAPT P10636 1/20 0.54
RAB9A P51151 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PRMT5 O14744 1/20 0.53
WDR77 Q9BQA1 1/20 0.53
TBXA2R P21731 3/20 0.52
CYP2C9 P11712 1/20 0.51

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
SCHEMBL5585647 0.90 CSNK2A1 (0.52) HPGDSPTGER1CSNK2A1AMY1ATYR
SCHEMBL5585878 0.89 PTGER1 (0.56) PTGER1MAPTTBXA2RCYP2C9
SCHEMBL5585704 0.88 CSNK2A1 (0.68) HPGDSCSNK2A1AMY1ATYRMEN1
SCHEMBL5585515 0.80 PTGER1 (0.55) PTGER1MAPTSMN1; SMN2TBXA2RCYP2C9
SCHEMBL5585641 0.80 PTGER1 (0.55) PTGER1TBXA2RCYP2C9
SCHEMBL5585818 0.80 PTGER1 (0.47) PTGER1TBXA2RCYP2C9
SCHEMBL5585748 0.80 PTGER1 (0.54) PTGER1TBXA2RCYP2C9
SCHEMBL5585682 0.78 CSNK2A1 (0.62) HPGDSCSNK2A1AMY1ATYRMEN1
SCHEMBL5585496 0.78 PTGER1 (0.52) PTGER1TBXA2RCYP2C9
SCHEMBL5585539 0.77 KMT2A (0.57) HPGDSCSNK2A1MEN1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7163952-B2 Azole compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2007-01-16 US disclosed
US-7163952-B2 Azole compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2007-01-16 US disclosed
US-20050065196-A1 Azole compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-24 US disclosed
EP-1452530-A1 AZOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP 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 (1 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-20050065196-A1 Azole compound and medicinal use thereof PTPN7, PTPN1, PTPN5 HPGDS 3401/4885PTGER1 3758/4885CSNK2A1 124/4885

“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.