SCHEMBL30280405

SCHEMBL30280405

Cc1ccc(S(=O)(=O)n2cc(-c3ccc4c(c3)CCN(C(=O)OC(C)(C)C)C4)c3cc(Br)cnc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.44
▸ PTPN11 Q06124 1/20 0.43
▸ HTR6 P50406 1/20 0.41
▸ NR1H2 P55055 2/20 0.39
▸ OPRK1 P41145 2/20 0.37
▸ KIT P10721 1/20 0.36
▸ MMP13 P45452 1/20 0.35
▸ KCNA1 Q09470 1/20 0.34
▸ KCNAB1 Q14722 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ OPRD1 P41143 1/20 0.34
▸ ABHD6 Q9BV23 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34
▸ MKNK1 Q9BUB5 1/20 0.34

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 0.82 PTPN11 (0.42) ESR2PTPN11HTR6MMP13NAMPT
SCHEMBL31396526 0.81 PTPN11 (0.41) ESR2PTPN11HTR6MEN1KMT2A
SCHEMBL31662630 0.79 ESR2 (0.46) ESR2HTR6NR1H2KITMMP13
SCHEMBL30893060 0.78 PTPN11 (0.45) PTPN11HTR6NR1H2KITGPR119
SCHEMBL30215942 0.78 PTPN11 (0.45) PTPN11HTR6NR1H2KITGPR119
SCHEMBL29216553 0.78 PTPN11 (0.45) PTPN11HTR6NR1H2KITGPR119
SCHEMBL15607338 0.78 TBK1 (0.48) PTPN11GPR119
SCHEMBL31662443 0.78 ESR2 (0.44) ESR2HTR6NR1H2KITMMP13
SCHEMBL15778729 0.77 BRD4 (0.47) ESR2PTPN11HTR6NR1H2NAMPT
SCHEMBL31396616 0.77 PTPN11 (0.53) PTPN11HTR6ALDH1A1MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240425499-A1 TYRO3 INHIBITORS HALIA THERAPEUTICS INC (US) 2024-12-26 — — US disclosed
WO-2023064218-A1 TYRO3 INHIBITORS Halia Therapeutics, Inc. (US) 2023-04-20 — — WO 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 ESR2 2913/4885PTPN11 80/4885HTR6 1025/4885

“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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