SCHEMBL659496

SCHEMBL659496

CC(=O)NC1CCN(CCC(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.49
KDM1A O60341 2/20 0.48
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
GLA P06280 1/20 0.44
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
CHRM1 P11229 2/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
EPHX1 P07099 1/20 0.40
EPHX2 P34913 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL26095596 0.83 L3MBTL1 (0.48) KDM1ACARM1PRMT6SIGMAR1CHRM1
SCHEMBL8144691 0.82 LTA4H (0.48) LTA4HDRD2DRD3CARM1PRMT6
SCHEMBL669964 0.82 LTA4H (0.45) LTA4HDRD2DRD3CARM1PRMT6
SCHEMBL13136091 0.82 EPHX1 (0.56) LTA4HSMN1; SMN2EPHX1EPHX2L3MBTL1
SCHEMBL10064191 0.81 LTA4H (0.47) LTA4HDRD2DRD3CARM1PRMT6
SCHEMBL4681787 0.79 CHRM1 (0.48) LTA4HDRD2DRD3CARM1PRMT6
SCHEMBL4681793 0.79 CHRM1 (0.48) LTA4HDRD2DRD3CARM1PRMT6
SCHEMBL26661838 0.79 KCNA3 (0.61) KDM1ADRD2DRD3EPHX1L3MBTL1
SCHEMBL4681635 0.78 LTA4H (0.44) LTA4HDRD2DRD3CHRM1EPHX1
SCHEMBL12337290 0.78 EPHX1 (0.54) LTA4HSMN1; SMN2EPHX1EPHX2L3MBTL1

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-20120283260-A1 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA ASTELLAS PHARMA INC. (JP) 2012-11-08 US disclosed
US-8252793-B2 Bradykinin receptor agonists and uses thereof to treat ocular hypertension and glaucoma ALCON RESEARCH, LTD. (US) 2012-08-28 US disclosed
WO-2012024419-A2 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA ALCON RESEARCH, LTD. (US) 2012-02-23 WO disclosed
US-20120046285-A1 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA ASTELLAS PHARMA INC. (JP) 2012-02-23 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-20120283260-A1 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA BDKRB2, BDKRB1, PTGIR LTA4H 160/4885KDM1A 2708/4885DRD2 2283/4885
US-20120046285-A1 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA BDKRB2, BDKRB1, PTGIR LTA4H 160/4885KDM1A 2708/4885DRD2 2283/4885

“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.