SCHEMBL9739839

SCHEMBL9739839

CC[C@@](O)(c1ccco1)C1CCCC[C@H]1N

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
USP2 O75604 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 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
SCHEMBL9739846 1.00 MAPT (0.37) MAPTUSP2ALDH1A1HPGD
SCHEMBL15130391 0.70 MAPT (0.41) MAPTUSP2ALDH1A1HPGD
SCHEMBL11239388 0.67 MAPT (0.50) MAPTALDH1A1HPGD
SCHEMBL4631766 0.67 MAPT (0.50) MAPTALDH1A1HPGD
SCHEMBL15130395 0.67 MAPT (0.41) MAPTUSP2ALDH1A1HPGD
SCHEMBL27720869 0.65 MAPT (0.45) MAPT
SCHEMBL7310504 0.65 ALDH1A1 (0.39) MAPTUSP2ALDH1A1HPGD
SCHEMBL7310511 0.65 ALDH1A1 (0.39) MAPTUSP2ALDH1A1HPGD
SCHEMBL28418585 0.64 MAPT (0.47) MAPTALDH1A1HPGD
SCHEMBL13992799 0.63 MAPT (0.39) MAPTUSP2ALDH1A1HPGD

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-5104869-A Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1992-04-14 US disclosed