SCHEMBL22015371

SCHEMBL22015371

CC(C)(C)OC(=O)N1C[C@@H]2CN(c3c(F)c(F)c(F)c(F)c3F)C[C@@H]2C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.50
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
NAMPT P43490 1/20 0.42
AOC3 Q16853 1/20 0.41
GPR119 Q8TDV5 4/20 0.41
PDE10A Q9Y233 2/20 0.40
LIPE Q05469 1/20 0.39
RORC P51449 1/20 0.39
USP30 Q70CQ3 2/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL17135075 0.78 HDAC1 (0.55) NR1H2HDAC1HDAC2GPR119LIPE
SCHEMBL31288397 0.78 HDAC1 (0.55) NR1H2HDAC1HDAC2GPR119LIPE
SCHEMBL31288417 0.78 HDAC1 (0.55) NR1H2HDAC1HDAC2GPR119LIPE
SCHEMBL22014823 0.77 MEN1 (0.46) AOC3SMN1; SMN2
SCHEMBL19078501 0.76 GPR119 (0.50) NR1H2HDAC1HDAC2GPR119LIPE
SCHEMBL30040816 0.75 GPR119 (0.50) NR1H2GPR119PDE10A
SCHEMBL15092041 0.75 GPR119 (0.50) NR1H2GPR119PDE10A
SCHEMBL25967032 0.75 HDAC1 (0.42) NR1H2HDAC1HDAC2NAMPTAOC3
SCHEMBL24693307 0.75 NR1H2 (0.60) NR1H2HDAC1HDAC2NAMPTGPR119
SCHEMBL18711408 0.75 NR1H2 (0.60) NR1H2HDAC1HDAC2NAMPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220017516-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-01-20 US disclosed
WO-2020099886-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-05-22 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-20220017516-A1 LOX INHIBITORS LOXL1, LOX, LOXL2 NR1H2 344/4885HDAC1 1487/4885HDAC2 2830/4885

“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.