SCHEMBL9922972

SCHEMBL9922972

CNc1ccc2c(=O)n(-c3ccc(NC(=O)NS(=O)(=O)c4cc(Cl)c(C)s4)cc3)cc(C(=O)NCCN3CCOCC3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.42
CNR1 P21554 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
KMT2A Q03164 1/20 0.37
ABCB1 P08183 1/20 0.37

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
SCHEMBL12161541 0.94 EPHX2 (0.43) EPHX2CNR1SMN1; SMN2KMT2AABCB1
SCHEMBL9922261 0.91 EPHX2 (0.43) EPHX2CNR1SMN1; SMN2KMT2AABCB1
SCHEMBL12177178 0.91 EPHX2 (0.43) EPHX2CNR1SMN1; SMN2CA1CA2
SCHEMBL9922601 0.88 EPHX2 (0.41) EPHX2CNR1
SCHEMBL9922974 0.86 MAPT (0.39) SMN1; SMN2CA1CA2CA9KMT2A
SCHEMBL9922264 0.84 P2RY12 (0.45) EPHX2CNR1CA1CA2
SCHEMBL12177207 0.84 EPHX2 (0.41) EPHX2CNR1CA1CA2CA9
SCHEMBL9922427 0.84 EPHX2 (0.42) EPHX2CNR1SMN1; SMN2KMT2A
SCHEMBL9923107 0.82 EPHX2 (0.40) EPHX2CNR1SMN1; SMN2KMT2A
SCHEMBL9922814 0.81 EPHX2 (0.46) EPHX2CNR1SMN1; SMN2KMT2A

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 3 patents. 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
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 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 (2 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 EPHX2 3275/4885CNR1 264/4885SMN1; SMN2 3108/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 EPHX2 3266/4885CNR1 253/4885SMN1; SMN2 3093/4885

“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.