SCHEMBL9044441

SCHEMBL9044441

[CH2]CN1CCCC1CCO

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VEGFA P15692 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
POLB P06746 1/20 0.35
TERT O14746 2/20 0.35
S1PR1 P21453 2/20 0.34
S1PR3 Q99500 2/20 0.34
S1PR5 Q9H228 2/20 0.34
S1PR4 O95977 1/20 0.34
ALDH1A1 P00352 3/20 0.34
ALOX15 P16050 2/20 0.34
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
SIGMAR1 Q99720 2/20 0.30

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
SCHEMBL11101486 0.94 TERT (0.39) VEGFAEGLN1TERTS1PR1S1PR3
SCHEMBL5424648 0.83
SCHEMBL5428965 0.83
SCHEMBL1406334 0.83
SCHEMBL20999795 0.81 ALDH1A1 (0.49) VEGFAEGLN1L3MBTL1S1PR1S1PR3
SCHEMBL6629974 0.81 ALDH1A1 (0.49) VEGFAEGLN1L3MBTL1S1PR1S1PR3
SCHEMBL6636120 0.81 S1PR1 (0.41) VEGFAEGLN1L3MBTL1POLBTERT
SCHEMBL25379496 0.79 VEGFA (0.37) VEGFAEGLN1L3MBTL1POLBTERT
Iodide SCHEMBL22034640 0.78 VEGFA (0.36) VEGFAEGLN1L3MBTL1POLBTERT
Iodide SCHEMBL22034682 0.78 VEGFA (0.36) VEGFAEGLN1L3MBTL1POLBTERT

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
EP-0450066-B1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1996-09-11 EP disclosed
US-5401740-A FOR INHIBITING PLATELET AGGREGATION OTSUKA PHARMACEUTICAL CO. (JP) 1995-03-28 US disclosed
EP-0450066-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-10-09 EP disclosed