SCHEMBL6841570

SCHEMBL6841570

[CH2]C1=CN(CC(=O)O)CC=C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.31
ACE P12821 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
SCHEMBL3740352 0.65 HTT (0.30)
Hydrochloric Acid SCHEMBL6274273 0.64
Bromide SCHEMBL16412115 0.64
SCHEMBL9475840 0.63 APEX1 (0.38)
SCHEMBL15271918 0.63 ALDH1A1 (0.31)
Oxalic Acid SCHEMBL28748123 0.63
SCHEMBL16649247 0.63 HTT (0.32)
SCHEMBL2599231 0.63 ALDH1A1 (0.31)
SCHEMBL1652278 0.61
SCHEMBL7858452 0.61 HSD17B10 (0.31) HSD17B10

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-6759384-B1 LOW MOLECULAR WEIGHT ANTICOAGULANTS WITHOUT SIDE EFFECTS; DERIVATIVES OF AT LEAST PROLINE, LEUCINE AND ARGININE SEQUENCE AVENTIS PHARMACEUTICALS INC. 2004-07-06 US disclosed