SCHEMBL10201113

SCHEMBL10201113

CCNC(=O)Nc1ccc(O)c(Br)n1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 14/20 0.47
MAPK8 P45983 11/20 0.47
MAPK9 P45984 11/20 0.47
MAPK10 P53779 11/20 0.47
MAPK1 P28482 9/20 0.47
MAPK14 Q16539 1/20 0.44

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
SCHEMBL10201115 0.81 MAPK1 (0.55) PIK3CAMAPK8MAPK9MAPK10MAPK1
SCHEMBL10201100 0.76 HCAR3 (0.39)
SCHEMBL1552411 0.76 CHRNB2 (0.51) PIK3CAMAPK8MAPK9MAPK10MAPK1
SCHEMBL9033586 0.75 PEPD (0.38) MAPK1
SCHEMBL27897933 0.73 RAB9A (0.74)
SCHEMBL1933915 0.72 MAPK1 (0.63) PIK3CAMAPK8MAPK9MAPK10MAPK1
SCHEMBL29351108 0.71 RAB9A (0.74)
SCHEMBL5449305 0.70 PIK3CA (0.70) PIK3CAMAPK8MAPK9MAPK10MAPK1
SCHEMBL5454854 0.70 PIK3CA (0.66) PIK3CAMAPK8MAPK9MAPK10MAPK1
SCHEMBL4675273 0.70 PIK3CA (0.60) PIK3CAMAPK8MAPK9MAPK10MAPK1

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-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 US disclosed
US-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 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-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, ADAMTS1, ADAMTS7 PIK3CA 3211/4885MAPK8 1346/4885MAPK9 1730/4885

“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.