SCHEMBL18160896

SCHEMBL18160896

COc1c(/C=C/C(=O)O)cc(NS(=O)(=O)c2cccs2)c2c1OCCO2

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNKSR1 Q969H4 13/20 0.67
AKT1 P31749 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.45
BCL2A1 Q16548 1/20 0.45
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
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
SCHEMBL20798600 0.94 CNKSR1 (0.76) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL15811477 0.94 CNKSR1 (0.76) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL17200780 0.94 CNKSR1 (0.76) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL18160885 0.88 CNKSR1 (0.75) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL18160892 0.88 CNKSR1 (0.64) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL18160878 0.84 CNKSR1 (0.79) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL17211661 0.83 CNKSR1 (0.63) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL15811504 0.83 CNKSR1 (0.81) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL17211718 0.82 CNKSR1 (0.64) CNKSR1AKT1SMN1; SMN2BCL2A1ALDH1A1
SCHEMBL17211659 0.82 CNKSR1 (0.80) CNKSR1AKT1ALDH1A1MEN1MAPT

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-10227356-B2 Compounds, compositions and methods for inhibiting CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2019-03-12 US disclosed
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-10-20 US disclosed
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-10-20 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 (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-10227356-B2 Compounds, compositions and methods for inhibiting CNKSR1 CNKSR1, CAMKK1, CNR1 CNKSR1 1/4885AKT1 780/4885SMN1; SMN2 3032/4885
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 CNKSR1, CAMKK1, CNR1 CNKSR1 1/4885AKT1 780/4885SMN1; SMN2 3032/4885

“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.