SCHEMBL799349

SCHEMBL799349

CC(C)NC(=O)c1ccccc1NC(=O)Nc1nc2c(s1)CN(c1ccc(S(C)(=O)=O)c(F)c1)CC2

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PIK3CG P48736 9/20 0.42
GCK P35557 4/20 0.41
TP53 P04637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL799095 0.88 LMNA (0.42) LMNAMEN1KMT2APIK3CGGCK
SCHEMBL799354 0.88 GCK (0.49) LMNAMEN1KMT2APIK3CGGCK
SCHEMBL799350 0.87 GCK (0.47) LMNAMEN1KMT2APIK3CGGCK
SCHEMBL798956 0.86 PIK3CG (0.40) LMNAMEN1KMT2APIK3CGGCK
SCHEMBL799087 0.84 PIK3CG (0.51) LMNAMEN1KMT2APIK3CGGCK
SCHEMBL799269 0.84 PIK3CG (0.51) LMNAMEN1KMT2APIK3CGNPC1
SCHEMBL799317 0.84 LMNA (0.43) LMNAMEN1KMT2APIK3CGTP53
SCHEMBL799158 0.83 PIK3CG (0.44) LMNAMEN1KMT2APIK3CG
SCHEMBL799274 0.83 PIK3CG (0.53) LMNAMEN1KMT2APIK3CGTP53
SCHEMBL172045 0.83 PIK3CG (0.54) LMNAMEN1KMT2APIK3CGGCK

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-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-03-22 US disclosed
US-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-03-22 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-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY MTOR, STAT3, SLC14A1 LMNA 4258/4885MEN1 2694/4885KMT2A 2921/4885

“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.