SCHEMBL6132625

SCHEMBL6132625

CC1CCC(N2CCN(c3ccc(-c4nnc(-c5ccc(C=O)cc5)s4)cc3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
HRH3 Q9Y5N1 11/20 0.45
ALDH1A1 P00352 3/20 0.44
TRIM24 O15164 1/20 0.40
TRIM33 Q9UPN9 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL6134672 1.00 MEN1 (0.49) MEN1KMT2AHRH3ALDH1A1TRIM24
SCHEMBL6690335 0.88 HRH3 (0.52) HRH3ALDH1A1TRIM24TRIM33KDM4E
SCHEMBL6132213 0.85 KMT2A (0.49) MEN1KMT2AHRH3
SCHEMBL6132623 0.84 MEN1 (0.49) MEN1KMT2AHRH3
SCHEMBL6132621 0.84 MEN1 (0.49) MEN1KMT2AHRH3
SCHEMBL6135370 0.83 USP2 (0.55) MEN1KMT2AHRH3SMN1; SMN2
SCHEMBL6135376 0.83 USP2 (0.55) MEN1KMT2AHRH3SMN1; SMN2
SCHEMBL6134791 0.82 MEN1 (0.49) MEN1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL6134795 0.82 MEN1 (0.49) MEN1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL13099185 0.81 MEN1 (0.44) MEN1KMT2AHRH3

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 4 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 claimed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP claimed
US-20050004014-A1 Fungicides, microbiocides; glucanase inhibitor; prophylaxis, therapy for pneumocystis infections in humans, animals FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-06 US disclosed
WO-2004113368-A1 CYCLIC LIPOPEPTIDES ASTELLAS PHARMA INC. (JP) 2004-12-29 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-20050004014-A1 Fungicides, microbiocides; glucanase inhibitor; prophylaxis, therapy for pneumocystis infections in humans, animals MAN2B1, MAN2A1, MANBA MEN1 1376/4885KMT2A 4054/4885HRH3 2668/4885

“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.