SCHEMBL6132511

SCHEMBL6132511

CCOC(=O)c1ccc(N2CCN(c3ccc(N4CCC(SCCCCCCOC)CC4)cc3)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 3/20 0.41
HPGD P15428 2/20 0.41
FDFT1 P37268 1/20 0.39
HSP90AA1 P07900 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 4/20 0.39
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
METAP1 P53582 1/20 0.38

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
SCHEMBL6132901 0.87 USP2 (0.50) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL6132520 0.86 HTT (0.47) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6132838 0.83 GFER (0.45) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6132393 0.83 HTT (0.44) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6132246 0.83 HTT (0.44) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6132749 0.82 HTT (0.43) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6132957 0.81 HRH3 (0.55) ALDH1A1TSHRMEN1KMT2AHPGD
SCHEMBL6132310 0.81 HTT (0.44) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6134734 0.80 HRH3 (0.51) ALDH1A1TSHRMEN1KMT2AHTT
SCHEMBL6134438 0.80 MEN1 (0.44) ALDH1A1TSHRMEN1KMT2AHTT

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-6884868-B1 Cyclic hexapeptides having antibiotic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-26 US disclosed
EP-1173472-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-23 EP disclosed
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO disclosed