SCHEMBL6132920

SCHEMBL6132920

COCCCCOC1CCCCN1c1ccc(-c2nn3cc(-c4ccc(C(=O)O)cc4)nc3s2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
TP53 P04637 4/20 0.42
LMNA P02545 2/20 0.42
CA12 O43570 7/20 0.40
CA1 P00915 7/20 0.40
CA2 P00918 7/20 0.40
CA9 Q16790 7/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
PDE4D Q08499 1/20 0.37
PDE7A Q13946 1/20 0.37
F2RL3 Q96RI0 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
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
SCHEMBL6132778 0.98 MAPT (0.42) MAPTTP53LMNACA12CA1
SCHEMBL6132851 0.91 MAPT (0.42) MAPTTP53LMNACA12CA1
SCHEMBL6132654 0.89 MAPT (0.42) MAPTTP53LMNACA12CA1
SCHEMBL6132854 0.88 MAPT (0.39) MAPTTP53LMNACA12CA1
SCHEMBL6132659 0.88 MAPT (0.38) MAPTTP53LMNACA12CA1
SCHEMBL6132169 0.85 MAPT (0.43) MAPTTP53LMNACA12CA1
SCHEMBL6132446 0.84 HDAC3 (0.39) MAPTTP53LMNACA12CA1
SCHEMBL6132995 0.82 HDAC3 (0.39) MAPTTP53LMNACA12CA1
SCHEMBL6135097 0.81 MAPT (0.45) MAPTTP53LMNACA12CA1
Hydrochloric Acid SCHEMBL6135061 0.80 MAPT (0.44) MAPTTP53LMNACA12CA1

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