SCHEMBL6133892

SCHEMBL6133892

COCCCCCCOC1CCC(N2CCC(c3ccc(-c4nnc(-c5ccc(C(=O)O)cc5)s4)cc3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 10/20 0.42
CSNK2A1 P68400 10/20 0.42
DGAT1 O75907 3/20 0.41
WNT3A P56704 3/20 0.41
HRH3 Q9Y5N1 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
ESRRG P62508 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CSNK2B P67870 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
SCHEMBL6134373 0.92 DGAT1 (0.41) CSNK2A2CSNK2A1DGAT1WNT3AHRH3
SCHEMBL6132358 0.88 CSNK2A2 (0.42) CSNK2A2CSNK2A1WNT3AHRH3NR1H4
SCHEMBL6132483 0.88 CSNK2A2 (0.42) CSNK2A2CSNK2A1WNT3AHRH3NR1H4
SCHEMBL6134711 0.83 CSNK2A2 (0.51) CSNK2A2CSNK2A1DGAT1HRH3NR1H4
SCHEMBL6134501 0.83 HDAC3 (0.42) DGAT1WNT3AHRH3ESRRG
SCHEMBL6132376 0.82 CSNK2A2 (0.46) CSNK2A2CSNK2A1HRH3NR1H4CSNK2B
SCHEMBL6135499 0.81 KDM4E (0.42) HRH3ESRRG
SCHEMBL6134955 0.81 HRH3 (0.41) WNT3AHRH3
Hydrochloric Acid SCHEMBL6134979 0.81 CSNK2A2 (0.45) CSNK2A2CSNK2A1HRH3NR1H4CSNK2B
Hydrochloric Acid SCHEMBL6132312 0.81 CSNK2A2 (0.45) CSNK2A2CSNK2A1HRH3NR1H4CSNK2B

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 CSNK2A2 1527/4885CSNK2A1 961/4885DGAT1 3670/4885

“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.