SCHEMBL6132838

SCHEMBL6132838

COCCCCCCSC1CCN(c2ccc(N3CCN(C(C)=O)CC3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 3/20 0.45
CASP6 P55212 1/20 0.45
MAPT P10636 11/20 0.43
ALDH1A1 P00352 8/20 0.43
HIF1A Q16665 1/20 0.43
RORC P51449 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
SYK P43405 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
USP2 O75604 2/20 0.41
LMNA P02545 4/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALOX15 P16050 4/20 0.40
MAPK1 P28482 4/20 0.40
GAA P10253 3/20 0.40
ALOX12 P18054 3/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 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
SCHEMBL6132901 0.86 USP2 (0.50) GFERMAPTALDH1A1KMT2AMEN1
SCHEMBL6132511 0.83 ALDH1A1 (0.41) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL6132615 0.81 ADRB1 (0.44)
SCHEMBL7417183 0.81 KDM4E (0.34) MAPTALDH1A1KMT2AMEN1SYK
SCHEMBL6133068 0.79 MAPT (0.64) GFERCASP6MAPTALDH1A1HIF1A
SCHEMBL6132899 0.74 HDAC3 (0.49) GFERMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL6132745 0.72 RAB9A (0.41) MAPTALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL30862674 0.71 MAPT (0.63) GFERCASP6MAPTALDH1A1HIF1A
SCHEMBL6132776 0.71 GPR119 (0.44) MAPTALDH1A1SMN1; SMN2USP2NPC1
SCHEMBL6538956 0.69 MAPT (0.71) GFERCASP6MAPTALDH1A1HIF1A

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