SCHEMBL24557910

SCHEMBL24557910

CSc1ncnn2c(C3(O)O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@@H]3F)cnc12

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 2/20 0.34
▸ PTPN1 P18031 6/20 0.33
▸ CDC25B P30305 6/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ HSPA5 P11021 1/20 0.32
▸ BCHE P06276 1/20 0.31
▸ PTPN2 P17706 2/20 0.30
▸ PTPN6 P29350 2/20 0.30
▸ PTPN11 Q06124 2/20 0.30

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
SCHEMBL17106669 0.93 PTPN1 (0.34) PDE2APTPN1CDC25BHTR1AHSPA5
SCHEMBL19412708 0.93 PTPN1 (0.34) PDE2APTPN1CDC25BHTR1AHSPA5
SCHEMBL18788247 0.87 PDE2A (0.35) PDE2APTPN1CDC25BHTR1AHSPA5
SCHEMBL22579701 0.83 HRH4 (0.31) —
SCHEMBL22569896 0.83 TNK2 (0.31) —
SCHEMBL17131351 0.81 TSHR (0.31) —
SCHEMBL19758149 0.81 TSHR (0.31) —
SCHEMBL24160877 0.81 PDE2A (0.34) PDE2APTPN1CDC25BHTR1ABCHE
SCHEMBL18788242 0.81 PDE2A (0.34) PDE2APTPN1CDC25BHTR1ABCHE
SCHEMBL17106824 0.80 PTPN1 (0.36) PDE2APTPN1CDC25BHTR1AHSPA5

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-20220204539-A1 CD73 INHIBITORS BIOARDIS LLC 2022-06-30 — — US disclosed
US-20220204539-A1 CD73 INHIBITORS BIOARDIS LLC 2022-06-30 — — US disclosed
EP-3956341-A1 CD73 INHIBITORS Bioardis LLC (US) 2022-02-23 — — EP 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-20220204539-A1 CD73 INHIBITORS ENTPD5, ENTPD1, ENTPD2 PDE2A 431/4885PTPN1 922/4885CDC25B 2277/4885

“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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