SCHEMBL6134912

SCHEMBL6134912

O=C(O)c1ccc(-c2nnc(-c3ccc(N4CCC(OCC5CCCCC5)CC4)cc3)s2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.43
CSNK2A2 P19784 8/20 0.42
CSNK2A1 P68400 8/20 0.42
NR1H4 Q96RI1 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
XDH P47989 1/20 0.40
PDE4D Q08499 1/20 0.40
PDE7A Q13946 1/20 0.40
MAP4K4 O95819 1/20 0.40
HRH1 P35367 1/20 0.40
CCR3 P51677 1/20 0.40
KCNH2 Q12809 1/20 0.40
CSNK2B P67870 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
PPARA Q07869 1/20 0.38
CHEK1 O14757 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
SCHEMBL6135390 0.89 PDE4D (0.45) USP2HRH3PDE4DPDE7AALDH1A1
Hydrochloric Acid SCHEMBL7314046 0.82 CSNK2A2 (0.49) USP2CSNK2A2CSNK2A1NR1H4HRH3
SCHEMBL6132526 0.82 CSNK2A2 (0.45) USP2CSNK2A2CSNK2A1NR1H4HRH3
SCHEMBL6135503 0.82 CSNK2A2 (0.52) USP2CSNK2A2CSNK2A1NR1H4HRH3
SCHEMBL6135371 0.81 HDAC3 (0.43) USP2HRH3ALDH1A1TP53MAPT
SCHEMBL6235038 0.81 CSNK2A2 (0.46) USP2CSNK2A2CSNK2A1NR1H4PDE4D
SCHEMBL6134390 0.81 CSNK2A2 (0.53) USP2CSNK2A2CSNK2A1NR1H4CSNK2B
SCHEMBL6132376 0.80 CSNK2A2 (0.46) USP2CSNK2A2CSNK2A1NR1H4HRH3
SCHEMBL7340640 0.80 CSNK2A2 (0.54) USP2CSNK2A2CSNK2A1NR1H4HRH3
SCHEMBL6135608 0.79 NR1H4 (0.48) USP2CSNK2A2CSNK2A1NR1H4HRH3

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
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 WO 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 USP2 4776/4885CSNK2A2 1527/4885CSNK2A1 961/4885

“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.