SCHEMBL3947744

SCHEMBL3947744

COC(=O)/C=C1/CCCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.43
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GRM5 P41594 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
EPHX1 P07099 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.39
ESR2 Q92731 1/20 0.39
ADORA1 P30542 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
KDM4E B2RXH2 1/20 0.38
THRB P10828 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPN6 P29350 1/20 0.38

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
SCHEMBL3947745 1.00 HPGD (0.43) HPGDUSP2SMN1; SMN2GRM5MEN1
SCHEMBL106354 0.94 USP2 (0.46) HPGDUSP2SMN1; SMN2GRM5EPHX1
SCHEMBL20660348 0.89 NR1H2 (0.42) HPGDUSP2SMN1; SMN2MEN1KMT2A
SCHEMBL19342171 0.89 NR1H2 (0.42) HPGDUSP2SMN1; SMN2MEN1KMT2A
SCHEMBL9910665 0.86 ESR2 (0.46) USP2SMN1; SMN2GRM5EPHX1MAPT
SCHEMBL6024434 0.86 ESR2 (0.46) USP2SMN1; SMN2GRM5EPHX1MAPT
SCHEMBL6024437 0.86 ESR2 (0.46) USP2SMN1; SMN2GRM5EPHX1MAPT
SCHEMBL29052706 0.85 ADORA1 (0.45) HPGDUSP2SMN1; SMN2GRM5MEN1
SCHEMBL5379778 0.85 ADORA1 (0.45) HPGDUSP2SMN1; SMN2GRM5MEN1
SCHEMBL5379779 0.85 ADORA1 (0.45) HPGDUSP2SMN1; SMN2GRM5MEN1

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 HPGD 1713/4885USP2 967/4885SMN1; SMN2 2768/4885

“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.