SCHEMBL9602659

SCHEMBL9602659

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

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
ALDH1A1 P00352 5/20 0.33
GAA P10253 2/20 0.33
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
FKBP1A P62942 2/20 0.32
THRB P10828 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PPARD Q03181 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
SCHEMBL9602109 0.87 PPARD (0.35) MAPTALDH1A1GAAELANECTSG
SCHEMBL9603125 0.83 ELANE (0.33) MAPTALDH1A1ELANECTSGTHRB
SCHEMBL10677033 0.79 MAPT (0.39) MAPTALDH1A1GAAELANECTSG
SCHEMBL9602604 0.77 MAPT (0.38) MAPTALDH1A1GAAELANECTSG
SCHEMBL9603082 0.77 MAPT (0.38) MAPTALDH1A1GAAELANECTSG
SCHEMBL9603006 0.77 MAPT (0.33) MAPTALDH1A1GAAELANECTSG
SCHEMBL9602119 0.76 FKBP1A (0.36) MAPTALDH1A1GAAELANECTSG
SCHEMBL9602059 0.76 ELANE (0.39) MAPTALDH1A1GAAELANECTSG
SCHEMBL9602994 0.74 MAPT (0.35) MAPTALDH1A1GAAELANECTSG
SCHEMBL9602954 0.73 ELANE (0.37) MAPTALDH1A1GAAELANECTSG

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 6 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
EP-0203891-B1 CERTAIN PHOSPHONIC ACIDS AND DERIVATIVES CIBA-GEIGY AG (CH) 1991-05-15 EP 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-0203891-A2 Certain phosphonic acids and derivatives CIBA-GEIGY AG (CH) 1986-12-03 EP disclosed