SCHEMBL8622217

SCHEMBL8622217

CCN1CCN(C(=O)NC([C]=O)c2ccc(O)c(O)c2)C(=O)C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ MAPT P10636 5/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ SLC22A6 Q4U2R8 1/20 0.33
▸ SLC22A8 Q8TCC7 1/20 0.33
▸ SLC22A11 Q9NSA0 1/20 0.33
▸ HSD17B10 Q99714 4/20 0.33
▸ TSHR P16473 3/20 0.33
▸ THRB P10828 1/20 0.33
▸ TDP1 Q9NUW8 6/20 0.32
▸ KDM4E B2RXH2 4/20 0.32
▸ GAA P10253 3/20 0.32
▸ ADRB2 P07550 3/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ HIF1A Q16665 2/20 0.32
▸ BLM P54132 2/20 0.32
▸ RXFP1 Q9HBX9 2/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ NFKB1 P19838 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
SCHEMBL10546612 0.90 POLB (0.40) POLBSMN1; SMN2MAPTPDE3ASLC22A6
SCHEMBL10404262 0.90 POLB (0.35) POLBSMN1; SMN2MAPTPDE3ASLC22A6
SCHEMBL6875807 0.87 MAPT (0.39) POLBSMN1; SMN2MAPTPDE3ASLC22A6
SCHEMBL9347528 0.85 TNF (0.38) POLBSLC6A2HDAC1CYP2D6DRD2
SCHEMBL10540280 0.84 POLB (0.39) POLBSMN1; SMN2HSD17B10GAAL3MBTL1
SCHEMBL8626971 0.84 POLB (0.38) POLBSMN1; SMN2MAPTGAAHDAC1
SCHEMBL10490774 0.83 YARS1 (0.42) POLBSMN1; SMN2MAPTPDE3ASLC22A6
SCHEMBL10817167 0.83 TDP1 (0.40) POLBSMN1; SMN2MAPTPDE3ASLC22A6
SCHEMBL10543451 0.83 SMN1; SMN2 (0.34) POLBSMN1; SMN2MAPTPDE3ASLC22A6
SCHEMBL9329034 0.82 POLB (0.33) POLBSMN1; SMN2MAPTPDE3ASLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0503597-B1 Penam derivatives and processes for producing the same OTSUKA KAGAKU KK (JP) 1998-06-10 — — EP disclosed
US-5599925-A BACTERICIDES OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-02-04 — — US disclosed
US-5300497-A Broad spectrum antibiotics and bactericides; stable to beta-lactamase; effective against antibiotic-resistant bacteria TOYAMA CHEMICAL CO., LTD. (JP) 1994-04-05 — — US disclosed
US-5185330-A Penicillins/ad/ TOYAMA CHEMICAL CO., LTD. (JP) 1993-02-09 — — US disclosed
EP-0503597-A2 Penam derivatives and processes for producing the same OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-09-16 — — EP disclosed
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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