SCHEMBL9607957

SCHEMBL9607957

C=C(O)C[C@@H](COC(=O)Nc1cc(-c2cccc(F)c2)no1)N(C)C(=O)NCc1cccc(F)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.38
SMN1; SMN2 Q16637 5/20 0.33
TP53 P04637 4/20 0.33
EPHX2 P34913 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
RORC P51449 1/20 0.31
MAPK1 P28482 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
SCHEMBL214098 0.90 MAPT (0.38) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL211761 0.89 MAPT (0.36) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL211762 0.89 MAPT (0.36) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL211760 0.89 MAPT (0.36) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL213927 0.89 MAPT (0.36) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL2728354 0.88 MAPT (0.36) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL210856 0.87 MAPT (0.35) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL2727292 0.87 MAPT (0.35) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL211389 0.87 MAPT (0.35) MAPTSMN1; SMN2TP53EPHX2KDM4E
SCHEMBL211390 0.87 MAPT (0.35) MAPTSMN1; SMN2TP53EPHX2KDM4E

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-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2012-05-31 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-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 MAPT 530/4885SMN1; SMN2 252/4885TP53 2206/4885

“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.