SCHEMBL12415880

SCHEMBL12415880

O=C(Nc1ccccc1Oc1ccccc1)N1CCOc2cccnc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
POLB P06746 1/20 0.48
GAA P10253 3/20 0.46
PKM P14618 1/20 0.46
RXFP1 Q9HBX9 2/20 0.45
THRB P10828 1/20 0.45
LCK P06239 3/20 0.45
MET P08581 3/20 0.45
KDR P35968 3/20 0.45
TEK Q02763 3/20 0.45
GRM5 P41594 2/20 0.45
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.43
RECQL P46063 2/20 0.43
ADRA2C P18825 1/20 0.42
MAPK1 P28482 1/20 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
SCHEMBL12415875 0.85 MAPT (0.54) MAPTGAARXFP1LCKMET
SCHEMBL12415902 0.84 HCAR2 (0.48) MAPTPOLBRXFP1THRBGRM5
SCHEMBL12415869 0.83 RXFP1 (0.47) MAPTPOLBGAARXFP1THRB
SCHEMBL12415867 0.82 RXFP1 (0.54) MAPTPOLBGAARXFP1THRB
SCHEMBL12415805 0.82 MAPT (0.52) MAPTGAARXFP1THRBLCK
SCHEMBL12415865 0.81 KMT2A (0.54) MAPTPOLBRXFP1THRBKMT2A
SCHEMBL12415887 0.81 RXFP1 (0.56) MAPTPOLBRXFP1THRBGRM5
SCHEMBL5340638 0.77 GRM5 (0.51) GRM5KMT2ASMN1; SMN2TSHRMAPK1
SCHEMBL12415859 0.77 GPR142 (0.57) MAPTPOLBPKMLCKMET
SCHEMBL12415866 0.77 MAPT (0.49) MAPTRXFP1LCKMETKDR

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 MAPT 2999/4885POLB 1278/4885GAA 1741/4885

“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.