SCHEMBL6132932

SCHEMBL6132932

CC(C)(C)C1CCC(N2CCN(c3ccc(C(=O)O)cc3)CC2)CC1

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.80
KMT2A Q03164 2/20 0.80
USP2 O75604 1/20 0.56
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
ALOX15 P16050 1/20 0.50
TRPV6 Q9H1D0 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
MBTD1 Q05BQ5 1/20 0.47
TP53BP1 Q12888 1/20 0.47
L3MBTL4 Q8NA19 1/20 0.47
L3MBTL3 Q96JM7 1/20 0.47
KDM4E B2RXH2 5/20 0.47
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.45
OPRL1 P41146 1/20 0.45
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
CHEK1 O14757 1/20 0.43

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
SCHEMBL6132350 0.96 MEN1 (0.74) MEN1KMT2AUSP2ITGB3ITGA2B
SCHEMBL6132349 0.96 MEN1 (0.74) MEN1KMT2AUSP2ITGB3ITGA2B
SCHEMBL1305974 0.90 USP2 (0.63) MEN1KMT2AUSP2ITGB3ITGA2B
SCHEMBL4553154 0.84 L3MBTL3 (0.57) MEN1KMT2AUSP2ITGB3ITGA2B
SCHEMBL1304508 0.84 USP2 (0.59) MEN1KMT2AUSP2ITGB3ITGA2B
SCHEMBL6132707 0.82 KMT2A (0.70) MEN1KMT2AITGB3ITGA2BALOX15
SCHEMBL6132216 0.82 MEN1 (0.70) MEN1KMT2AITGB3ITGA2BALOX15
SCHEMBL6132703 0.82 KMT2A (0.70) MEN1KMT2AITGB3ITGA2BALOX15
SCHEMBL6134910 0.82 USP2 (0.67) MEN1KMT2AUSP2ITGB3ITGA2B
SCHEMBL6135516 0.82 USP2 (0.67) MEN1KMT2AUSP2ITGB3ITGA2B

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