SCHEMBL7270331

SCHEMBL7270331

CCCCN1CCCC1(C)N

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.33
EBP Q15125 1/20 0.33
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
S1PR5 Q9H228 1/20 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
SCHEMBL10922207 0.88 OPRM1 (0.31)
SCHEMBL11817414 0.82 PARP1 (0.34)
SCHEMBL5585759 0.79 S1PR1 (0.32) SIGMAR1EBPS1PR1S1PR3S1PR5
SCHEMBL10867277 0.79
SCHEMBL3298354 0.79
SCHEMBL9150873 0.79
Hydrochloric Acid SCHEMBL27461147 0.77
SCHEMBL5585723 0.76 S1PR1 (0.30) S1PR1S1PR3S1PR5
SCHEMBL11049865 0.74 MEN1 (0.31) S1PR1S1PR3S1PR5
SCHEMBL23251421 0.73 S1PR1 (0.31) SIGMAR1EBPS1PR1S1PR3S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0407137-B1 Benzazine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL (JP) 1996-05-01 EP disclosed
EP-0407137-A2 Benzazine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-01-09 EP disclosed