SCHEMBL6132882

SCHEMBL6132882

O=C(C1CCCC[N]1)N1CCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 1/20 0.41
HTT P42858 2/20 0.38
TFPI2 P48307 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
HSD11B1 P28845 2/20 0.33
GRM5 P41594 1/20 0.33

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
SCHEMBL2200249 0.96 HPGD (0.47) ALDH1A1HPGDTSHRLMNAHTT
SCHEMBL3060452 0.90 HPGD (0.48) ALDH1A1HPGDTSHRHTTSMN1; SMN2
SCHEMBL8860937 0.88 HPGD (0.52) ALDH1A1HPGDTSHRLMNAHTT
SCHEMBL2202337 0.85 ALDH1A1 (0.41) ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL3950467 0.81 HPGD (0.52) ALDH1A1HPGDTSHRHTTSMN1; SMN2
SCHEMBL3312314 0.79 ALDH1A1 (0.42) ALDH1A1HPGDTSHRLMNASMN1; SMN2
SCHEMBL4372871 0.79 HPGD (0.56) ALDH1A1HPGDTSHRLMNAHTT
SCHEMBL3913964 0.73 HPGD (0.46) ALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL3911205 0.73 HPGD (0.42) ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL3552654 0.72 CHRNB2 (0.36) ALDH1A1HPGDTSHRLMNAHTT

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 6 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 claimed
EP-1173472-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-23 EP claimed
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO claimed
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