SCHEMBL8576163

SCHEMBL8576163

[CH2][C@H]1CCCN(C(=N)N)C1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.48
▸ CPN1 P15169 2/20 0.44
▸ CPB2 Q96IY4 2/20 0.44
▸ EED O75530 4/20 0.37
▸ NOS2 P35228 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
SCHEMBL6280009 1.00 F2 (0.48) F2CPN1CPB2EEDNOS2
SCHEMBL6275890 0.87 — —
SCHEMBL3123799 0.79 ALDH1A1 (0.36) CPN1CPB2
SCHEMBL9147164 0.77 CA12 (0.52) F2CPN1CPB2EED
SCHEMBL9059444 0.77 CA12 (0.52) F2CPN1CPB2EED
SCHEMBL9387897 0.77 CA12 (0.52) F2CPN1CPB2EED
SCHEMBL4550909 0.75 ALDH1A1 (0.50) F2CPN1CPB2EED
SCHEMBL8574653 0.75 ALDH1A1 (0.50) F2CPN1CPB2EED
SCHEMBL8574654 0.75 ALDH1A1 (0.50) F2CPN1CPB2EED
Hydrochloric Acid SCHEMBL2722390 0.73 ALDH1A1 (0.49) F2CPN1CPB2EED

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763436-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1998-06-09 — — US disclosed
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