SCHEMBL31396526

SCHEMBL31396526

Cc1ccc(S(=O)(=O)n2cc(-c3ccc4c(c3)CCN(C(=O)OC(C)(C)C)C4)c3cc(-c4ccc(CN5CCCC(CO)C5)cc4)cnc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.41
▸ CYP2D6 P10635 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MOGAT2 Q3SYC2 4/20 0.34
▸ PREP P48147 1/20 0.34
▸ HTR6 P50406 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33
▸ CHEK2 O96017 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ BCHE P06276 1/20 0.33

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
SCHEMBL30280390 0.93 PTPN11 (0.42) PTPN11ESR2MOGAT2PREPHTR6
SCHEMBL31396505 0.88 PTPN11 (0.43) PTPN11CYP2D6MEN1KMT2AMOGAT2
SCHEMBL30280414 0.84 PTPN11 (0.43) PTPN11CYP2D6HTR6CD274CHEK2
SCHEMBL30280401 0.81 PTPN11 (0.45) PTPN11CYP2D6MEN1KMT2AHTR6
SCHEMBL30280405 0.81 ESR2 (0.44) PTPN11ESR2MEN1KMT2AHTR6
SCHEMBL25153562 0.78 CHEK1 (0.39) ESR2KMT2A
SCHEMBL12067531 0.78 PTPN11 (0.45) PTPN11MEN1KMT2AGPR119TP53
SCHEMBL31396521 0.78 PTPN11 (0.50) PTPN11HTR6
SCHEMBL22324681 0.76 PTPN11 (0.47) PTPN11MEN1KMT2AGPR119TP53
SCHEMBL12068204 0.76 PTPN11 (0.42) PTPN11GPR119

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-20240425499-A1 TYRO3 INHIBITORS HALIA THERAPEUTICS INC (US) 2024-12-26 — — 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-20240425499-A1 TYRO3 INHIBITORS TYRO3, TYR, TH PTPN11 80/4885CYP2D6 1813/4885ESR2 2913/4885

“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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