SCHEMBL1900283

SCHEMBL1900283

CCCCNS(=O)(=O)c1ccc(NC(=O)c2cccc(Cn3nc(C(F)(F)F)c4c3CCCC4)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
TP53 P04637 3/20 0.44
LMNA P02545 6/20 0.44
GRIA2 P42262 1/20 0.43
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 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
SCHEMBL1007385 0.88 GRIA2 (0.49) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1900284 0.87 MAPT (0.49) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1006093 0.83 MAPT (0.57) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1891273 0.82 SMN1; SMN2 (0.56) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1006821 0.81 MAPT (0.53) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1895488 0.78 MAPT (0.69) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1895722 0.78 MAPT (0.56) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1008025 0.78 MAPT (0.53) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1893494 0.77 POLB (0.54) MAPTCYP1A2CYP3A4CYP2C19TP53
SCHEMBL1009106 0.77 GRIA2 (0.54) MAPTCYP1A2CYP3A4CYP2C19TP53

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-20110118236-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-19 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-20110118236-A1 HETEROCYCLIC COMPOUND GRIN1, GRM1, GRIK1 MAPT 4623/4885CYP1A2 2476/4885CYP3A4 2926/4885

“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.