SCHEMBL6134964

SCHEMBL6134964

COCCCCCCN1CCC(Oc2ccc(Br)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.60
RECQL P46063 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
RAB9A P51151 1/20 0.47
HRH3 Q9Y5N1 9/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
CCR1 P32246 1/20 0.44
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL14862765 0.89 KDM4E (0.51) KDM4ERECQLTDP1ATML3MBTL1
SCHEMBL6135261 0.82 KMT2A (0.50) KDM4EHRH3KMT2AALDH1A1LMNA
SCHEMBL6134473 0.81 OPRM1 (0.52) KDM4EHRH3KMT2AALDH1A1LMNA
SCHEMBL6135365 0.78 OPRM1 (0.49) KDM4EHRH3KMT2AALDH1A1LMNA
SCHEMBL24659069 0.77 HRH3 (0.49) KDM4ERECQLTDP1HRH3CARM1
SCHEMBL21801764 0.77 HRH3 (0.68) KDM4ERECQLTDP1L3MBTL1HRH3
SCHEMBL15829842 0.76 HRH3 (0.51) HRH3CARM1PRMT6KMT2ALMNA
SCHEMBL6135422 0.75 SLC6A2 (0.60) KDM4ERECQLTDP1ATML3MBTL1
SCHEMBL6134380 0.75 HRH1 (0.49) KDM4EHRH3KMT2AALDH1A1LMNA
SCHEMBL578384 0.75 HRH3 (0.63) HRH3SMN1; SMN2ALDH1A1

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 KDM4E 4301/4885RECQL 2001/4885TDP1 1365/4885

“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.