SCHEMBL560413

SCHEMBL560413

CC(C)(C)C(=O)NCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.71
FPR2 P25090 13/20 0.71
LMNA P02545 6/20 0.71
MAPT P10636 6/20 0.71
SMN1; SMN2 Q16637 5/20 0.71
CYP3A4 P08684 4/20 0.71
MAPK1 P28482 4/20 0.71
TP53 P04637 3/20 0.71
RAD52 P43351 3/20 0.71
ALDH1A1 P00352 2/20 0.71
CYP1A2 P05177 2/20 0.71
ABCB1 P08183 2/20 0.71
HTR1A P08908 2/20 0.71
ADRA2A P08913 2/20 0.71
ADORA3 P0DMS8 2/20 0.71
CYP2D6 P10635 2/20 0.71
CHRM1 P11229 2/20 0.71
DRD2 P14416 2/20 0.71
ADRA2B P18089 2/20 0.71
ADRA2C P18825 2/20 0.71

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
SCHEMBL560511 0.94 KIF11 (0.70) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL10168899 0.91 KIF11 (0.73) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL561459 0.91 FPR2 (0.68) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL560221 0.89 KIF11 (0.68) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL10168902 0.88 KIF11 (0.70) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL10136952 0.88 HTR1A (0.56) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL10168897 0.87 FPR2 (0.70) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL560237 0.87 FPR2 (0.67) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL10168895 0.87 KIF11 (0.68) KIF11FPR2LMNAMAPTSMN1; SMN2
SCHEMBL10168440 0.86 FPR2 (0.68) KIF11FPR2LMNAMAPTSMN1; SMN2

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-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same CORRIDOR PHARMACEUTICALS, INC. 2012-02-09 US claimed
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same CORRIDOR PHARMACEUTICALS, INC. 2012-02-09 US disclosed
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same CORRIDOR PHARMACEUTICALS, INC. 2012-02-09 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-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same NFATC1, BAX, BCL2 KIF11 3636/4885FPR2 153/4885LMNA 301/4885

“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.