SCHEMBL4171901

SCHEMBL4171901

CC(C)(C)OC(=O)N1CCN(c2cc(F)cc3c2OCCO3)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 4/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GPR119 Q8TDV5 4/20 0.40
SMARCA2 P51531 1/20 0.40
SMARCA4 P51532 1/20 0.40
PBRM1 Q86U86 1/20 0.40
PDK2 Q15119 1/20 0.39
SCD5 Q86SK9 1/20 0.39
GRIA1 P42261 1/20 0.38
HTR1A P08908 1/20 0.37
HTT P42858 1/20 0.37
USP30 Q70CQ3 1/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37

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
SCHEMBL7816467 0.87 USP2 (0.43) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4174667 0.86 MEN1 (0.44) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL7807619 0.86 USP2 (0.43) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL7821960 0.85 ALDH1A1 (0.44) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4169044 0.83 EGLN2 (0.43) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4471680 0.82 MAPK1 (0.41) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL21198677 0.81 ADRB1 (0.52) LMNAALDH1A1HTR1A
Hydrochloric Acid SCHEMBL16703615 0.78 EGLN2 (0.40) USP2SMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL31052173 0.76 HTR1A (0.43) LMNAALDH1A1HTR1A
SCHEMBL4941538 0.75 MAPT (0.56) USP2SMN1; SMN2MAPTLMNAALDH1A1

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-20090076274-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED 2009-03-19 US disclosed
US-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders GLAXO GROUP LIMITED (GB) 2006-11-23 US disclosed
EP-1562917-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2005-08-17 EP disclosed
WO-2004046124-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2004-06-03 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 (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-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders XDH, CYP4X1, PDHX USP2 3515/4885SMN1; SMN2 1090/4885MAPT 2057/4885
US-20090076274-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS XDH, CYP4X1, PDHX USP2 3492/4885SMN1; SMN2 336/4885MAPT 1924/4885

“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.