SCHEMBL6132254

SCHEMBL6132254

O=C(O)c1ccc(-c2nnc(-c3ccc(N4CCN(C5CCC(c6ccccc6)CC5)CC4)cc3)s2)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
RECQL P46063 1/20 0.47
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TRPV6 Q9H1D0 6/20 0.45
HRH3 Q9Y5N1 2/20 0.44
CSNK2A2 P19784 1/20 0.43
CSNK2A1 P68400 1/20 0.43
DGAT1 O75907 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
SCHEMBL6135547 0.87 HRH3 (0.52) MEN1KMT2AHRH3CSNK2A2CSNK2A1
Hydrochloric Acid SCHEMBL7333163 0.87 KDM4E (0.55) KDM4ERECQLALDH1A1MEN1KMT2A
SCHEMBL6135376 0.86 USP2 (0.55) MEN1KMT2AHRH3CSNK2A2CSNK2A1
SCHEMBL6135370 0.86 USP2 (0.55) MEN1KMT2AHRH3CSNK2A2CSNK2A1
SCHEMBL6134406 0.86 HRH3 (0.53) MEN1KMT2AHRH3CSNK2A2CSNK2A1
SCHEMBL6134222 0.86 HRH3 (0.53) MEN1KMT2AHRH3CSNK2A2CSNK2A1
SCHEMBL6134820 0.85 HRH3 (0.47) KDM4EMEN1KMT2AHRH3CSNK2A2
SCHEMBL6132210 0.82 HDAC3 (0.43) KDM4ERECQLALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL6132609 0.82 HRH3 (0.44) KDM4EMEN1KMT2AHRH3CSNK2A2
SCHEMBL6374374 0.80 HRH3 (0.54) HRH3CSNK2A2CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884774-B2 Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-26 US disclosed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed
US-20030083238-A1 Cyclic hexapeptide derivatives ASTELLAS PHARMA INC. (JP) 2003-05-01 US disclosed
EP-1259535-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-27 EP disclosed
WO-2001060846-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 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-20030083238-A1 Cyclic hexapeptide derivatives NGLY1, ALG1, CHIT1 KDM4E 4687/4885RECQL 1260/4885ALDH1A1 4718/4885

“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.