SCHEMBL31511172

SCHEMBL31511172

COc1ccc(CSc2c(OC)cc(C3CN(C(=O)OC(C)(C)C)CCO3)cc2OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ STS P08842 2/20 0.39
▸ KDM1A O60341 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MMP1 P03956 2/20 0.39
▸ MMP9 P14780 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP7 P09237 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ EPHA2 P29317 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ BMP1 P13497 1/20 0.37

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
SCHEMBL31510960 0.79 PDE4B (0.49) PDE4BSMN1; SMN2THRBSTSMMP1
SCHEMBL18310142 0.77 PDE4B (0.51) PDE4BSMN1; SMN2EPHA2ERBB2EPHB4
SCHEMBL31511051 0.75 PDE4B (0.46) PDE4BSMN1; SMN2STSMMP1MMP9
SCHEMBL1552953 0.74 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2STSLMNAMMP1
SCHEMBL1552058 0.74 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2STSLMNAMMP1
SCHEMBL30606466 0.74 PDE4B (0.50) PDE4BSTSEPHA2ERBB2EPHB4
SCHEMBL17002544 0.74 PDE4B (0.50) PDE4BSTSEPHA2ERBB2EPHB4
SCHEMBL31511064 0.74 PDE2A (0.41) ALDH1A1SMN1; SMN2GAALMNAHTT
SCHEMBL1990308 0.73 SMN1; SMN2 (0.42) PDE4BSMN1; SMN2GAATHRB
SCHEMBL1990310 0.73 SMN1; SMN2 (0.42) PDE4BSMN1; SMN2GAATHRB

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-20250122183-A1 Nitrogen-Linked Benzisoxazole Sulfonamide Derivatives PFIZER (US) 2025-04-17 — — US disclosed
WO-2025074249-A1 NITROGEN-LINKED BENZISOXAZOLE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF CANCER PFIZER INC. (US) 2025-04-10 — — 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-20250122183-A1 Nitrogen-Linked Benzisoxazole Sulfonamide Derivatives CCNI, MKI67, CCNA1 PDE4B 4001/4885ALDH1A1 761/4885SMN1; SMN2 1050/4885

“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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