SCHEMBL8628508

SCHEMBL8628508

CCC(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
POLB P06746 1/20 0.37
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
TRPA1 O75762 1/20 0.36
MMP2 P08253 2/20 0.33
MMP3 P08254 1/20 0.33
BIRC2 Q13490 1/20 0.33
PSMB5 P28074 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL13626169 1.00 CYP2C9 (0.38) CYP2C9POLBCTSSCTSKTRPA1
SCHEMBL10827228 0.80 FAAH (0.56) ALDH1A1
SCHEMBL19318580 0.79 POLB (0.41) POLBCTSSCTSKTRPA1MMP2
SCHEMBL19318533 0.79 POLB (0.41) POLBCTSSCTSKTRPA1MMP2
SCHEMBL2757967 0.79 POLB (0.41) POLBCTSSCTSKTRPA1MMP3
SCHEMBL16360269 0.79 CYP2C9 (0.42) CYP2C9MMP2MMP3ALDH1A1
SCHEMBL21579982 0.77 PSENEN (0.39) CYP2C9CTSSCTSK
SCHEMBL13611899 0.77 POLB (0.39) POLBCTSSCTSKTRPA1
SCHEMBL10067158 0.77 CYP2C9 (0.41) CYP2C9CTSSCTSKALDH1A1
SCHEMBL13758669 0.77 CYP2C9 (0.41) CYP2C9POLBCTSSCTSKALDH1A1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5322777-A Administering for bacterial infections; obtained from culture of Planobispora rosea ATCC 53773 GRUPPO LEPETIT S.P.A. (IT) 1994-06-21 US claimed
EP-0359062-B1 Antibiotic GE 2270 LEPETIT SPA (IT) 1994-02-16 EP claimed
US-5202241-A Spectrum analysis of physiochemical and biological properties; useful in treatment of infection diseases involving microorganism susceptible to them; culture product GRUPPO LEPETIT S.P.A. (IT) 1993-04-13 US claimed
EP-0359062-A2 Antibiotic GE 2270 GRUPPO LEPETIT S.p.A. (IT) 1990-03-21 EP claimed
US-5843890-A Antibiotic GE 2270 factors B1, B2, C1, C2, D1, D2, E and T GRUPPO LEPETIT S.P.A. (IT) 1998-12-01 US disclosed
US-5747295-A Antibiotic GE 2270 factors B1, B2, C1, C2, D1, D2, E and T GRUPPO LEPETIT S.P.A. (IT) 1998-05-05 US disclosed
EP-0451486-B1 Antibiotic GE 2270 factors B1, B2, C1, C2, D1, D2,E and T LEPETIT SPA (IT) 1995-04-19 EP disclosed
US-5322777-A Administering for bacterial infections; obtained from culture of Planobispora rosea ATCC 53773 GRUPPO LEPETIT S.P.A. (IT) 1994-06-21 US disclosed
EP-0359062-B1 Antibiotic GE 2270 LEPETIT SPA (IT) 1994-02-16 EP disclosed
US-5202241-A Spectrum analysis of physiochemical and biological properties; useful in treatment of infection diseases involving microorganism susceptible to them; culture product GRUPPO LEPETIT S.P.A. (IT) 1993-04-13 US disclosed
EP-0451486-A1 Antibiotic GE 2270 factors B1, B2, C1, C2, D1, D2,E and T GRUPPO LEPETIT S.p.A. (IT) 1991-10-16 EP disclosed
EP-0359062-A2 Antibiotic GE 2270 GRUPPO LEPETIT S.p.A. (IT) 1990-03-21 EP disclosed