SCHEMBL12415867

SCHEMBL12415867

Cc1ccccc1NC(=O)N1CCOc2cccnc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.54
MAPT P10636 4/20 0.53
THRB P10828 2/20 0.53
GAA P10253 3/20 0.51
KMT2A Q03164 1/20 0.51
ITGB1 P05556 1/20 0.50
ITGA4 P13612 1/20 0.50
LCK P06239 1/20 0.50
MET P08581 1/20 0.50
KDR P35968 1/20 0.50
TEK Q02763 1/20 0.50
TP53 P04637 3/20 0.46
FGFR4 P22455 1/20 0.44
PIK3R1 P27986 1/20 0.44
PIK3CA P42336 1/20 0.44
POLB P06746 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL12415865 0.85 KMT2A (0.54) RXFP1MAPTTHRBKMT2APOLB
SCHEMBL12415902 0.85 HCAR2 (0.48) RXFP1MAPTTHRBPOLBLMNA
SCHEMBL12415887 0.84 RXFP1 (0.56) RXFP1MAPTTHRBKMT2ATP53
SCHEMBL12415869 0.84 RXFP1 (0.47) RXFP1MAPTTHRBGAATP53
SCHEMBL12415864 0.83 MAPT (0.53) RXFP1MAPTLCKMETKDR
SCHEMBL12415805 0.83 MAPT (0.52) RXFP1MAPTTHRBGAAKMT2A
SCHEMBL12415880 0.82 MAPT (0.54) RXFP1MAPTTHRBGAAKMT2A
SCHEMBL12415862 0.81 LCK (0.53) RXFP1MAPTTHRBGAAKMT2A
SCHEMBL12415872 0.78 NPSR1 (0.53) RXFP1MAPTGAAKMT2AKDR
SCHEMBL12415858 0.78 TRPV1 (0.53) RXFP1MAPTTHRBGAALCK

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-20110172217-A1 RING-FUSED MORPHOLINE DERIVATIVE HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2011-07-14 US disclosed
US-20110172217-A1 RING-FUSED MORPHOLINE DERIVATIVE HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2011-07-14 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-20110172217-A1 RING-FUSED MORPHOLINE DERIVATIVE HAVING PI3K-INHIBITING ACTIVITY PIK3R3, AKT3, AKT2 RXFP1 3699/4885MAPT 2999/4885THRB 2639/4885

“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.