SCHEMBL4388167

SCHEMBL4388167

CC(C)(C)OC(=O)N1CCC(CN2CCNCC2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.46
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
PKM P14618 1/20 0.44
TP53 P04637 1/20 0.42
GPR119 Q8TDV5 6/20 0.42
BACE1 P56817 1/20 0.42
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
HPGD P15428 1/20 0.41
FAAH O00519 1/20 0.40

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
SCHEMBL20352051 0.89 NR1H2 (0.43) FPR2KDM4EMAPTTHRBPKM
SCHEMBL1651532 0.88 GPR119 (0.47) KDM4EMAPTTHRBPKMGPR119
SCHEMBL2546063 0.84 FPR2 (0.48) FPR2KDM4EMAPTTHRBPKM
SCHEMBL27591836 0.82 USP19 (0.34) FPR2
SCHEMBL189570 0.81 FPR2 (0.51) FPR2KDM4EMAPTTHRBPKM
SCHEMBL27189395 0.81 FPR2 (0.46) FPR2KDM4EMAPTTHRBPKM
SCHEMBL30288922 0.80 DRD2 (0.50)
SCHEMBL29056036 0.80 FPR2 (0.50) FPR2KDM4EMAPTTHRBPKM
SCHEMBL412749 0.79 HPGD (0.47) KDM4EMAPTTHRBPKMGPR119
SCHEMBL26128387 0.79 HPGD (0.51) FPR2KDM4EMAPTTHRBPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US disclosed
US-6680312-B2 FOR THERAPY OF CARDIAC INFARCTION, CEREBRAL THROMBOSIS; INHIBIT ACTIVATED COAGULATION FACTOR X (FXA) TO SHOW ANTI-COAGULANT ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-01-20 US disclosed
US-20020193382-A1 Sulfonamide derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2002-12-19 US disclosed
US-6403595-B1 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-11 US disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed
EP-1054005-A1 SULFONAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND UTILIZATION THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-11-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 FPR2 1465/4885KDM4E 2943/4885MAPT 4874/4885
US-20020193382-A1 Sulfonamide derivatives, their production and use F12, F11, F2 FPR2 357/4885KDM4E 1392/4885MAPT 4851/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.