SCHEMBL25169259

SCHEMBL25169259

O=P(O)(O)c1ccc(-c2ccc(P(=O)(O)O)cn2)nc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA5A P35218 1/20 0.42
▸ P4HTM Q9NXG6 4/20 0.41
▸ P4HA1 P13674 2/20 0.41
▸ CCR1 P32246 1/20 0.37
▸ CCR5 P51681 1/20 0.37
▸ CCR8 P51685 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ HPGDS O60760 1/20 0.33
▸ FBP1 P09467 1/20 0.32
▸ LDHA P00338 1/20 0.31
▸ CCNT1 O60563 1/20 0.31
▸ CDK9 P50750 1/20 0.31
▸ BAZ2B Q9UIF8 1/20 0.31

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
SCHEMBL17773854 0.88 KDM4E (0.52) CA2CA4CA5AP4HTMCCR1
SCHEMBL12313551 0.85 KDM4E (0.34) CA2CA4CA5AP4HTMP4HA1
SCHEMBL8607426 0.79 CA2 (0.41) CA2CA4CA5ALMNATSHR
SCHEMBL30434585 0.78 CCNT1 (0.33) CA2CA4CA5AP4HTMP4HA1
SCHEMBL25217533 0.78 CCNT1 (0.33) CA2CA4CA5AP4HTMP4HA1
SCHEMBL13459606 0.77 HDAC1 (0.46) CA2CA4CA5AHDAC6LMNA
SCHEMBL14076802 0.76 LMNA (0.44) CA2CA4CA5AP4HTMP4HA1
SCHEMBL11991137 0.74 NPC1 (0.40) P4HTMP4HA1CCR1CCR5CCR8
SCHEMBL19342205 0.73 KDM4E (0.48) CA2CA4CA5AP4HTMCCR1
SCHEMBL25221122 0.73 KCNQ3 (0.39) CA2CA4CA5A

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-20250296942-A1 Phosphonate-Based Coordination Complexes and Methods of Preparation and Use Thereof LOPEZ MEJIAS VILMALI (US) 2025-09-25 — — US disclosed
WO-2023081474-A9 PHOSPHONATE-BASED COORDINATION COMPLEXES AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF PUERTO RICO (US) 2024-04-25 — — WO disclosed
WO-2023081474-A2 PHOSPHONATE-BASED COORDINATION COMPLEXES AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF PUERTO RICO (US) 2023-05-11 — — 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-20250296942-A1 Phosphonate-Based Coordination Complexes and Methods of Preparation and Use Thereof PHOSPHO1, PPIP5K2, INPP5B CA2 111/4885CA4 293/4885CA5A 1971/4885

“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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