SCHEMBL1543589

SCHEMBL1543589

CC(=O)[C@H]1CC[C@@H](NC(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ ATM Q13315 1/20 0.35
▸ BTK Q06187 1/20 0.35
▸ EPHX2 P34913 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GRIN1 Q05586 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33
▸ EPHX1 P07099 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ MME P08473 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ MMP8 P22894 1/20 0.31
▸ TLR4 O00206 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL23825900 1.00 FASN (0.38) FASNPOLBATMBTKEPHX2
SCHEMBL572181 0.89 POLB (0.43) POLBEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL572180 0.89 POLB (0.43) POLBEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL15733075 0.89 POLB (0.43) POLBEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL23826924 0.88 BTK (0.47) BTKEPHX2ALDH1A1KDM4EGRIN1
SCHEMBL23826543 0.88 BTK (0.47) BTKEPHX2ALDH1A1KDM4EGRIN1
SCHEMBL23826989 0.84 ATM (0.39) POLBATMBTKALDH1A1KDM4E
SCHEMBL23826990 0.84 ATM (0.39) POLBATMBTKALDH1A1KDM4E
SCHEMBL21877336 0.82 BTK (0.44) POLBBTKEPHX2ALDH1A1
SCHEMBL5007222 0.81 POLB (0.41) POLBATMBTKEPHX2ALDH1A1

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-20220024921-A1 1,3,4-OXADIAZOLONE COMPOUND AND PHARMACEUTICAL NIPPON SHINYAKU CO., LTD. (JP) 2022-01-27 — — US disclosed
EP-3882239-A1 1,3,4-OXADIAZOLONE COMPOUND AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2021-09-22 — — EP disclosed
EP-2307377-A1 NICOTINAMIDE DERIVATIVES Pfizer Limited (GB) 2011-04-13 — — EP disclosed
WO-2009153720-A1 NICOTINAMIDE DERIVATIVES PFIZER LIMITED (GB) 2009-12-23 — — WO 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-20220024921-A1 1,3,4-OXADIAZOLONE COMPOUND AND PHARMACEUTICAL PIM1, PIM3, PIM2 FASN 3403/4885POLB 3559/4885ATM 4266/4885

“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.

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