SCHEMBL12142188

SCHEMBL12142188

C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.50
▸ USP30 Q70CQ3 2/20 0.47
▸ HPGD P15428 1/20 0.45
▸ USP2 O75604 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ RECQL P46063 1/20 0.43
▸ RORC P51449 1/20 0.41
▸ EPHX1 P07099 1/20 0.40
▸ DDB1 Q16531 1/20 0.39
▸ CRBN Q96SW2 1/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ CHRM2 P08172 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ CHRM3 P20309 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PREP P48147 1/20 0.38
▸ EPHX2 P34913 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
SCHEMBL16224550 1.00 NR1H2 (0.50) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL17510289 1.00 NR1H2 (0.50) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL16727831 1.00 NR1H2 (0.50) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL16080222 1.00 NR1H2 (0.50) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL31363276 0.86 NR1H2 (0.45) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL13801217 0.86 NR1H2 (0.58) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL15764146 0.86 NR1H2 (0.58) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL12035619 0.86 NR1H2 (0.58) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL15764147 0.86 NR1H2 (0.58) NR1H2USP30HPGDUSP2SMN1; SMN2
SCHEMBL17438450 0.85 NR1H2 (0.50) NR1H2USP30HPGDUSP2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022140647-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2022-06-30 — — WO disclosed
US-8067589-B2 Heterocyclic compounds useful in treating diseases and conditions PFIZER INC (US) 2011-11-29 — — US disclosed
US-20090281125-A1 Heterocyclic Compounds Useful in Treating Diseases and Conditions BLAKE TANISHA D 2009-11-12 — — US disclosed
US-7582643-B2 Heterocyclic compounds useful in treating diseases and conditions PFIZER INC (US) 2009-09-01 — — US disclosed
US-20080207651-A1 Heterocyclic compounds useful in treating diseases and conditions BLAKE TANISHA D 2008-08-28 — — 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 (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-20090281125-A1 Heterocyclic Compounds Useful in Treating Diseases and Conditions CYP11B2, CYP11B1, LTC4S NR1H2 240/4885USP30 4116/4885HPGD 57/4885
US-20080207651-A1 Heterocyclic compounds useful in treating diseases and conditions CYP11B2, CYP11B1, LTC4S NR1H2 240/4885USP30 4116/4885HPGD 57/4885

“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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