SCHEMBL6132621

SCHEMBL6132621

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

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
HRH3 Q9Y5N1 11/20 0.45
POLB P06746 1/20 0.36

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
SCHEMBL6132623 1.00 MEN1 (0.49) MEN1KMT2AHRH3POLB
SCHEMBL6132213 0.85 KMT2A (0.49) MEN1KMT2AHRH3
SCHEMBL6134672 0.84 MEN1 (0.49) MEN1KMT2AHRH3
SCHEMBL6132625 0.84 MEN1 (0.49) MEN1KMT2AHRH3
SCHEMBL6135370 0.83 USP2 (0.55) MEN1KMT2AHRH3
SCHEMBL6135376 0.83 USP2 (0.55) MEN1KMT2AHRH3
SCHEMBL6134791 0.82 MEN1 (0.49) MEN1KMT2AHRH3
SCHEMBL6134795 0.82 MEN1 (0.49) MEN1KMT2AHRH3
SCHEMBL6132464 0.78 ALDH1A1 (0.45) MEN1KMT2AHRH3POLB
SCHEMBL6134157 0.77 HRH3 (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 2 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