SCHEMBL9511620

SCHEMBL9511620

O=C(Cn1cccc(O)c1=O)NCCCN(CCCNC(=O)Cn1cccc(O)c1=O)C(=O)Cn1cccc(O)c1=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 4/20 0.56
▸ IL1RN P18510 2/20 0.56
▸ ERAP1 Q9NZ08 2/20 0.56
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ VEGFA P15692 1/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NR5A1 Q13285 1/20 0.37

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
SCHEMBL9513063 0.85 ERAP2 (0.64) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL9511617 0.85 ERAP2 (0.64) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL9385864 0.83 ERAP2 (0.62) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL8102437 0.82 ERAP2 (0.60) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL9512037 0.79 KDM4E (0.44) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL10966257 0.79 ERAP2 (0.63) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL8100239 0.79 ERAP2 (0.63) ERAP2IL1RNERAP1KDM4EALDH1A1
SCHEMBL9511646 0.76 KDM4E (0.42) KDM4EALDH1A1HSD17B10LMNAHTT
SCHEMBL9514385 0.76 KDM4E (0.42) KDM4EALDH1A1HSD17B10LMNAHTT
SCHEMBL8102037 0.76 ERAP2 (0.59) ERAP2IL1RNERAP1KDM4EVEGFA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0357150-B1 Pharmaceutical compositions BRITISH TECH GROUP (GB) 1993-12-08 — — EP claimed
US-5104865-A IRON COMPLEXES OF HYDROXYPYRIDONES USEFUL FOR TREATING IRON OVERLOAD NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-04-14 — — US claimed
US-4912118-A Therapy for toxic concentration of metal NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1990-03-27 — — US claimed
EP-0357150-A1 Pharmaceutical compositions BTG INTERNATIONAL LIMITED (GB) 1990-03-07 — — EP claimed
EP-0138421-A2 Hydroxypyridone derivatives and pharmaceutical compositions containing them NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1985-04-24 — — EP claimed
EP-0357150-B1 Pharmaceutical compositions BRITISH TECH GROUP (GB) 1993-12-08 — — EP disclosed
US-5104865-A IRON COMPLEXES OF HYDROXYPYRIDONES USEFUL FOR TREATING IRON OVERLOAD NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-04-14 — — US disclosed
US-4912118-A Therapy for toxic concentration of metal NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1990-03-27 — — US disclosed
EP-0357150-A1 Pharmaceutical compositions BTG INTERNATIONAL LIMITED (GB) 1990-03-07 — — EP disclosed
EP-0138421-A2 Hydroxypyridone derivatives and pharmaceutical compositions containing them NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1985-04-24 — — EP disclosed
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