SCHEMBL3880129

SCHEMBL3880129

CC(C)(C)OC(=O)N1CC/C(=C/C=O)C(C)(C)C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.41
GRM5 P41594 8/20 0.39
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESR2 Q92731 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
THRB P10828 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
ADORA1 P30542 1/20 0.36
EPHX1 P07099 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
RORC P51449 1/20 0.35

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
SCHEMBL3880132 1.00 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL29915399 0.84 NR1H2 (0.42) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL29614722 0.83 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL29614642 0.83 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3881785 0.82 GRM5 (0.42) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3878423 0.82 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3878421 0.82 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3881781 0.82 GRM5 (0.42) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL29915379 0.81 GRM5 (0.43) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL20658743 0.79 GRM5 (0.45) NR1H2GRM5USP2SMN1; SMN2ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511144-B2 Reverse hydroxamic acid derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2009-03-31 US disclosed
EP-1431285-B1 REVERSE HYDROXAMIC ACID DERIVATIVES KAKEN PHARMA CO LTD (JP) 2009-01-07 EP disclosed
US-20040242928-A1 Tumor necrosis factor converting enzyme inhibitor; antiarthritic agents; lupus; Crohn's disease; multiple sclerosis; antidiabetic agents; infections;; asthma; skin disorders; anemia STUDOR S.A. (LU) 2004-12-02 US disclosed
EP-1431285-A1 REVERSE HYDROXAMIC ACID DERIVATIVES Kaken Pharmaceutical Co., Ltd. (JP) 2004-06-23 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 (1 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-20040242928-A1 Tumor necrosis factor converting enzyme inhibitor; antiarthritic agents; lupus; Crohn's disease; multiple sclerosis; antidiabetic agents; infections;; asthma; skin disorders; anemia TNF, RNASE1, IFNAR1 NR1H2 214/4885GRM5 3136/4885USP2 967/4885

“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.