SCHEMBL2531185

SCHEMBL2531185

CCOc1ccc(-c2nnc(SCC(=O)Nc3cc(C)cc(F)c3)[nH]2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHKA P35790 1/20 0.47
MAPT P10636 8/20 0.43
TP53 P04637 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.42
THRB P10828 2/20 0.41
ENPP1 P22413 4/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 2/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL2530946 0.95 CHKA (0.51) CHKAMAPTTP53SMN1; SMN2LMNA
SCHEMBL2534691 0.88 CHKA (0.60) CHKAMAPTTP53LMNAMEN1
SCHEMBL2530997 0.87 CHKA (0.53) CHKAMAPTTP53SMN1; SMN2LMNA
SCHEMBL2531979 0.86 CHKA (0.52) CHKAMAPTTP53SMN1; SMN2LMNA
SCHEMBL2529713 0.86 SMN1; SMN2 (0.48) CHKAMAPTTP53SMN1; SMN2ENPP1
SCHEMBL2536349 0.84 TP53 (0.41) CHKAMAPTTP53SMN1; SMN2POLB
SCHEMBL2529715 0.84 MAPT (0.44) CHKAMAPTTP53SMN1; SMN2LMNA
SCHEMBL2531303 0.82 CHKA (0.54) CHKAMAPTTP53LMNAPOLB
SCHEMBL2533227 0.82 SMN1; SMN2 (0.46) MAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2534523 0.81 CHKA (0.68) CHKAMAPTTP53LMNATHRB

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-20110257211-A1 Small-Molecule Choline Kinase Inhibitors as Anti-Cancer Therapeutics ADVANCED CANCER THERAPEUTICS, LLC (US) 2011-10-20 US disclosed
US-20110257211-A1 Small-Molecule Choline Kinase Inhibitors as Anti-Cancer Therapeutics ADVANCED CANCER THERAPEUTICS, LLC (US) 2011-10-20 US disclosed
US-20110257211-A1 Small-Molecule Choline Kinase Inhibitors as Anti-Cancer Therapeutics ADVANCED CANCER THERAPEUTICS, LLC (US) 2011-10-20 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-20110257211-A1 Small-Molecule Choline Kinase Inhibitors as Anti-Cancer Therapeutics CHKA, CHKB, CEPT1 CHKA 1/4885MAPT 1448/4885TP53 1116/4885

“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.