SCHEMBL14587779

SCHEMBL14587779

OB(O)c1cccc(-c2nc3c(Cl)cccc3[nH]2)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 6/20 0.50
▸ GAA P10253 6/20 0.50
▸ SI P14410 6/20 0.50
▸ MGAM2 Q2M2H8 6/20 0.50
▸ PARP1 P09874 8/20 0.48
▸ ADORA3 P0DMS8 1/20 0.45
▸ ADORA1 P30542 1/20 0.45
▸ MGLL Q99685 1/20 0.42
▸ PSMB8 P28062 1/20 0.42
▸ DHODH Q02127 3/20 0.41

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
SCHEMBL27961298 0.79 ADORA1 (0.57) MGAMGAASIMGAM2PARP1
SCHEMBL4715207 0.78 GAA (0.54) MGAMGAASIMGAM2PARP1
SCHEMBL31192814 0.78 KDM4E (0.61) GAA
SCHEMBL1170768 0.77 ADORA1 (0.61) MGAMGAASIMGAM2PARP1
SCHEMBL4714942 0.76 PARP1 (0.52) MGAMGAASIMGAM2PARP1
SCHEMBL14587793 0.75 PSMB8 (0.56) MGAMGAASIMGAM2PARP1
SCHEMBL14587792 0.74 PARP1 (0.50) MGAMGAASIMGAM2PARP1
SCHEMBL14587799 0.74 PARP1 (0.50) MGAMGAASIMGAM2PARP1
SCHEMBL5628534 0.74 MGAM (0.46) MGAMGAASIMGAM2PARP1
SCHEMBL4717701 0.73 MGAM (0.48) MGAMGAASIMGAM2PARP1

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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 — — US disclosed
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 — — 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 (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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism BDKRB1, BDKRB2, NPBWR1 MGAM 4641/4885GAA 3511/4885SI 3857/4885

“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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