SCHEMBL5906232

SCHEMBL5906232

Cc1cc(Cn2nnn(-c3ccc(C(F)(F)F)c(C(F)(F)F)c3)c2=O)ccc1N

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 9/20 0.38
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36
ADORA1 P30542 1/20 0.36
PPARG P37231 7/20 0.36
PPARD Q03181 7/20 0.36
PPARA Q07869 7/20 0.36
NOTUM Q6P988 2/20 0.36
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
RAD52 P43351 1/20 0.34

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
SCHEMBL5906362 0.92 AR (0.41) ROCK2
SCHEMBL5906265 0.91 NOTUM (0.48) ROCK2NOTUM
SCHEMBL1829217 0.87 PPARD (0.45) ROCK2ADORA3ADORA2AADORA2BADORA1
SCHEMBL1827020 0.84 PPARG (0.39) ROCK2ADORA3ADORA2AADORA2BADORA1
SCHEMBL1829886 0.84 PPARG (0.44) PPARGPPARDPPARAKDM4EMAPT
SCHEMBL5906397 0.84 ROCK2 (0.45) ROCK2PPARGPPARDPPARA
SCHEMBL5906177 0.83 AR (0.41) ROCK2PPARGPPARDPPARANOTUM
SCHEMBL5906188 0.83 ROCK2 (0.48) ROCK2ADORA3ADORA2AADORA2BADORA1
SCHEMBL5906074 0.83 ROCK2 (0.41) ROCK2ADORA3ADORA2AADORA2BADORA1
SCHEMBL5906250 0.83 PPARG (0.43) ADORA3ADORA2AADORA2BADORA1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060223872-A1 Insecticidal phthalamide derivatives BAYER CROPSCIENCE AG (DE) 2006-10-05 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-20060223872-A1 Insecticidal phthalamide derivatives CRYAA, PRXL2A, H1-2 ROCK2 1976/4885ADORA3 2149/4885ADORA2A 2889/4885

“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.