SCHEMBL9602994

SCHEMBL9602994

CCOC(=O)C1C(CCC=O)CCN1C(=O)OCC

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
ELANE P08246 1/20 0.35
CTSG P08311 1/20 0.35
ALDH1A1 P00352 5/20 0.34
GAA P10253 2/20 0.34
RAB9A P51151 2/20 0.33
FKBP1A P62942 2/20 0.33
THRB P10828 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL9602059 0.86 ELANE (0.39) MAPTELANECTSGALDH1A1GAA
SCHEMBL10677033 0.85 MAPT (0.39) MAPTELANECTSGALDH1A1GAA
SCHEMBL9603082 0.84 MAPT (0.38) MAPTELANECTSGALDH1A1GAA
SCHEMBL9602604 0.81 MAPT (0.38) MAPTELANECTSGALDH1A1GAA
SCHEMBL9603006 0.80 MAPT (0.33) MAPTELANECTSGALDH1A1GAA
SCHEMBL9602002 0.78 ELANE (0.36) MAPTELANECTSGALDH1A1GAA
SCHEMBL9602109 0.77 PPARD (0.35) MAPTELANECTSGALDH1A1GAA
SCHEMBL9602954 0.77 ELANE (0.37) MAPTELANECTSGALDH1A1GAA
SCHEMBL9602575 0.76 ELANE (0.36) MAPTELANECTSGALDH1A1GAA
SCHEMBL7677235 0.75 MAPT (0.38) MAPTALDH1A1GAAFKBP1AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5217963-A Antiischemic, antiepileptic agent CIBA-GEIGY CORPORATION (US) 1993-06-08 US disclosed
US-5057506-A Anticonvulsants, antispasmodic and antischemic agents CIBA-GEIGY CORPORATION (US) 1991-10-15 US disclosed
US-4906621-A Certain 2-carboxypiperidyl-alkylene phosphonic acids and esters thereof useful for the treatment of disorders responsive to N-methyl-D-aspartate receptor blockade CIBA-GEIGY CORPORATION (US) 1990-03-06 US disclosed
US-4898854-A NERVOUS SYSTEM DISORDERS CIBA-GEIGY CORPORATION (US) 1990-02-06 US disclosed
EP-0275820-A2 Unsaturated phosphonic acids and derivatives CIBA-GEIGY AG (CH) 1988-07-27 EP disclosed