SCHEMBL6132273

SCHEMBL6132273

COCCCCCCCOc1c(C)cc(Br)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.54
KMT2A Q03164 7/20 0.54
MEN1 O00255 6/20 0.54
ALDH1A1 P00352 5/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2D6 P10635 2/20 0.54
TDP1 Q9NUW8 2/20 0.41
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
POLB P06746 1/20 0.37
S1PR2 O95136 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
KLK1 P06870 1/20 0.36
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL8417929 0.88 KMT2A (0.49) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL8648702 0.85 MEN1 (0.54) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL12634965 0.85 MEN1 (0.54) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL6132790 0.85 MEN1 (0.54) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL13313279 0.82 KMT2A (0.49) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL13313284 0.78 LMNA (0.53) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL13349221 0.78 KMT2A (0.37) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL6716155 0.78 KMT2A (0.42) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL27458128 0.78 KMT2A (0.50) KDM4EKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL5417671 0.76 S1PR2 (0.49) KDM4EKMT2AMEN1ALDH1A1CYP1A2

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