SCHEMBL18160876

SCHEMBL18160876

COc1c(/C=C/CO)c(NS(=O)(=O)c2cccs2)cc2c1OCCO2

nearest known ligand 0.86

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNKSR1 Q969H4 11/20 0.86
▸ TSHR P16473 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ POLB P06746 2/20 0.43
▸ AKT1 P31749 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ BCL2A1 Q16548 1/20 0.43
▸ TP53 P04637 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 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
SCHEMBL15811564 0.93 CNKSR1 (1.00) CNKSR1SMN1; SMN2POLBAKT1ALDH1A1
SCHEMBL18160878 0.88 CNKSR1 (0.79) CNKSR1TSHRHPGDMAPK1SMN1; SMN2
SCHEMBL18160877 0.86 CNKSR1 (1.00) CNKSR1TSHRHPGDMAPK1SMN1; SMN2
SCHEMBL18160910 0.85 CNKSR1 (0.86) CNKSR1SMN1; SMN2POLBAKT1ALDH1A1
SCHEMBL18160892 0.84 CNKSR1 (0.64) CNKSR1TSHRHPGDMAPK1SMN1; SMN2
SCHEMBL18163762 0.80 CNKSR1 (0.85) CNKSR1SMN1; SMN2AKT1ALDH1A1BCL2A1
SCHEMBL18163766 0.80 CNKSR1 (0.78) CNKSR1TSHRHPGDMAPK1SMN1; SMN2
SCHEMBL18163744 0.80 CNKSR1 (1.00) CNKSR1SMN1; SMN2AKT1ALDH1A1BCL2A1
SCHEMBL18163763 0.80 CNKSR1 (0.83) CNKSR1SMN1; SMN2AKT1ALDH1A1BCL2A1
SCHEMBL15811370 0.79 CNKSR1 (0.77) CNKSR1TSHRHPGDMAPK1SMN1; 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-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 1/4885TSHR 2655/4885HPGD 3849/4885
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 CNKSR1, CAMKK1, CNR1 CNKSR1 1/4885TSHR 2655/4885HPGD 3849/4885

“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.

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