SCHEMBL17323629

SCHEMBL17323629

CC(C)C(=O)N1CCCC[C@H]1C

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.53
GAA P10253 1/20 0.53
LIPE Q05469 1/20 0.47
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
DPP7 Q9UHL4 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HSD17B10 Q99714 1/20 0.40
LMNA P02545 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
SCHEMBL17323635 1.00 HPGD (0.53) HPGDGAALIPEALDH1A1HTT
SCHEMBL4546663 1.00 HPGD (0.53) HPGDGAALIPEALDH1A1HTT
SCHEMBL1106509 0.94 GAA (0.46) HPGDGAALIPEDPP7HSD17B10
SCHEMBL9927075 0.94 GAA (0.46) HPGDGAALIPEDPP7HSD17B10
SCHEMBL17323644 0.94 GAA (0.46) HPGDGAALIPEDPP7HSD17B10
SCHEMBL21204540 0.86 HPGD (0.51) HPGDGAALIPEALDH1A1HTT
SCHEMBL17323643 0.85 PIK3CD (0.41) HPGDGAALIPEALDH1A1HTT
SCHEMBL15113689 0.81 HPGD (0.50) HPGDGAALIPEALDH1A1HTT
SCHEMBL15113697 0.81 HPGD (0.50) HPGDGAALIPEALDH1A1HTT
SCHEMBL23073793 0.80 HPGD (0.46) HPGDGAALIPEALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230278998-A1 Compound containing structure of a five-membered heteroaromatic ring, pharmaceutical compositions thereof and applications thereof 280 BIO, INC. (US) 2023-09-07 US disclosed
US-20220411471-A1 CELL-PERMEABLE CYCLIC PEPTIDES AND USES THEREOF UNNATURAL PRODUCTS INC. 2022-12-29 US disclosed
US-11530193-B2 Kinase inhibitors THE UNIVERSITY OF MANCHESTER (GB) 2022-12-20 US disclosed
US-9963462-B2 Sepiapterin reductase inhibitors MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2018-05-08 US disclosed
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US 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 (5 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-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO HPGD 571/4885GAA 6/4885LIPE 222/4885
US-20220411471-A1 CELL-PERMEABLE CYCLIC PEPTIDES AND USES THEREOF TP53, MDM4, MDM2 HPGD 1521/4885GAA 2595/4885LIPE 3855/4885
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR HPGD 36/4885GAA 4235/4885LIPE 2654/4885
US-11530193-B2 Kinase inhibitors CAMKK2, CAMK1, CAMKK1 HPGD 1397/4885GAA 2326/4885LIPE 4422/4885
US-20230278998-A1 Compound containing structure of a five-membered heteroaromatic ring, pharmaceutical compositions thereof and applications thereof PARG, CYP3A5, CYP11B1 HPGD 55/4885GAA 96/4885LIPE 921/4885

“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.