SCHEMBL6134940

SCHEMBL6134940

COCCCCCCOC1CCC(N2CCC(Oc3ccc(C(=O)NNC(=O)c4ccc(C(=O)OC)cc4)cc3)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.48
KMT2A Q03164 2/20 0.41

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
SCHEMBL6135361 0.89 HRH3 (0.50) HRH3
SCHEMBL6134754 0.88 HRH3 (0.45) HRH3KMT2A
SCHEMBL6133692 0.87 KDM4E (0.39) HRH3KMT2A
SCHEMBL6134955 0.87 HRH3 (0.41) HRH3
SCHEMBL6132214 0.85 MEN1 (0.43) KMT2A
SCHEMBL6135499 0.83 KDM4E (0.42) HRH3
SCHEMBL6135365 0.83 OPRM1 (0.49) HRH3KMT2A
SCHEMBL6135385 0.82 HRH3 (0.60) HRH3KMT2A
SCHEMBL6132700 0.81 ALDH1A1 (0.46)
SCHEMBL6132706 0.81 ALDH1A1 (0.46)

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 HRH3 1440/4885KMT2A 4492/4885

“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.