SCHEMBL9922633

SCHEMBL9922633

CNc1ccc2c(=O)n(-c3ccc(NC(=O)NS(=O)(=O)c4ccc(C)s4)cc3Cl)cc(C(=O)NCCN(C)C)c2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.36
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
P2RY12 Q9H244 1/20 0.36
RPS6KB1 P23443 4/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
CYP1A2 P05177 1/20 0.33
MCHR1 Q99705 2/20 0.32
POLB P06746 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
CHEK1 O14757 1/20 0.31
HTT P42858 1/20 0.30
MAPK1 P28482 1/20 0.30
RAD52 P43351 1/20 0.30

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
SCHEMBL12160993 0.94 P2RY12 (0.41) SMN1; SMN2LMNAL3MBTL1P2RY12RPS6KB1
SCHEMBL9922283 0.92 P2RY12 (0.37) SMN1; SMN2LMNAL3MBTL1P2RY12RPS6KB1
SCHEMBL14113601 0.89 P2RY12 (0.38) SMN1; SMN2P2RY12RPS6KB1KMT2AMEN1
SCHEMBL12177071 0.89 P2RY12 (0.41) SMN1; SMN2LMNAL3MBTL1P2RY12RPS6KB1
SCHEMBL12160884 0.88 P2RY12 (0.45) SMN1; SMN2LMNAL3MBTL1P2RY12RPS6KB1
SCHEMBL9922047 0.86 RPS6KB1 (0.35) SMN1; SMN2LMNAL3MBTL1P2RY12RPS6KB1
SCHEMBL9922426 0.85 P2RY12 (0.38) P2RY12CA12CA1CA9
SCHEMBL9922463 0.85 P2RY12 (0.46) SMN1; SMN2LMNAP2RY12RPS6KB1KMT2A
SCHEMBL9922630 0.85 P2RY12 (0.42) SMN1; SMN2LMNAP2RY12KMT2AMEN1
SCHEMBL13638626 0.84 RPS6KB1 (0.34) SMN1; SMN2LMNAL3MBTL1RPS6KB1KMT2A

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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 SMN1; SMN2 3093/4885LMNA 3603/4885L3MBTL1 4538/4885

“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.