SCHEMBL28795624

SCHEMBL28795624

[Zn].c1cc(-c2ccncc2)ccn1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.92
▸ LMNA P02545 2/20 0.92
▸ NOTUM Q6P988 1/20 0.69
▸ KIF11 P52732 2/20 0.55
▸ DDAH1 O94760 1/20 0.53
▸ NOS1 P29475 1/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ PABPC1 P11940 1/20 0.52
▸ APOBEC3A P31941 1/20 0.52
▸ EIF4H Q15056 1/20 0.52
▸ APOBEC3G Q9HC16 1/20 0.52
▸ TP53 P04637 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ QDPR P09417 1/20 0.50
▸ CYP2D6 P10635 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48

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
SCHEMBL9728 0.96 MAPT (1.00) MAPTLMNANOTUMKIF11DDAH1
Hydrogen Sulfide SCHEMBL3929756 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
Hydrochloric Acid SCHEMBL3930145 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
SCHEMBL9120813 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
Water SCHEMBL11112402 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
Hydrochloric Acid SCHEMBL5548691 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
SCHEMBL135626 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
SCHEMBL10000032 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
Water SCHEMBL1648462 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1
Hydrochloric Acid SCHEMBL8372850 0.92 MAPT (0.92) MAPTLMNANOTUMKIF11DDAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114652843-B Medicament for treating ocular neovascularization, preparation method and application 厦门大学 2024-04-19 — — CN claimed
CN-114652843-A Medicine for treating eye neovascularization, preparation method and application 厦门大学 2022-06-24 — — CN claimed
CN-114652843-B Medicament for treating ocular neovascularization, preparation method and application 厦门大学 2024-04-19 — — CN disclosed
CN-114652843-B Medicament for treating ocular neovascularization, preparation method and application 厦门大学 2024-04-19 — — CN disclosed
CN-114652843-A Medicine for treating eye neovascularization, preparation method and application 厦门大学 2022-06-24 — — CN disclosed
CN-114652843-A Medicine for treating eye neovascularization, preparation method and application 厦门大学 2022-06-24 — — CN disclosed
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