SCHEMBL18130076

SCHEMBL18130076

[N-]=[N+]=Nc1ccc(C#Cc2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.47
▸ TP53 P04637 1/20 0.44
▸ CA2 P00918 4/20 0.40
▸ CA9 Q16790 4/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ CA12 O43570 3/20 0.37
▸ CA3 P07451 1/20 0.37
▸ CA6 P23280 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ PTGS2 P35354 2/20 0.36
▸ S100B P04271 1/20 0.35
▸ CYP51A1 Q16850 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ MMP3 P08254 1/20 0.33

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
SCHEMBL30476668 0.89 CA1 (0.47) APPTP53CA2CA9CA1
SCHEMBL13627732 0.87 TP53 (0.54) TP53CA2CA9CA1CA5A
SCHEMBL18130120 0.87 CA1 (0.41) APPTP53CA2CA9CA1
SCHEMBL18130074 0.83 CA1 (0.41) APPTP53CA2CA9CA1
SCHEMBL18130123 0.76 NQO2 (0.48) APPTP53CA2CA9CA1
SCHEMBL18130122 0.76 NQO2 (0.48) APPTP53CA2CA9CA1
SCHEMBL673609 0.75 APP (0.74) APPCA2CA9CA1CA5A
SCHEMBL14400750 0.75 APP (0.74) APPCA2CA9CA1CA5A
SCHEMBL16748959 0.75 CA1 (0.58) TP53CA2CA9CA1CA5A
SCHEMBL16341418 0.74 CA1 (0.39) TP53CA2CA9CA1CA5A

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
EP-3280402-B1 TOLAN COMPOUNDS FOR PROMOTING WOUND HEALING BIOMENDICS LLC (US) 2024-06-05 — — EP disclosed
US-11786481-B2 Formulation and process for modulating wound healing BioMendics, LLC (US) 2023-10-17 — — US disclosed
US-20210228501-A1 Formulation and Process for Modulating Wound Healing BioMendics, LLC (US) 2021-07-29 — — US disclosed
US-10426742-B2 Formulation and process for modulating wound healing BioMendics, LLC (US) 2019-10-01 — — US disclosed
US-20190022029-A1 Formulation and Process for Modulating Wound Healing BioMendics, LLC (US) 2019-01-24 — — US disclosed
US-20160296477-A1 Formulation and Process for Modulating Wound Healing BioMendics, LLC (US) 2016-10-13 — — US 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 (5 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-11786481-B2 Formulation and process for modulating wound healing SQSTM1, ATG7, TFEB APP 4010/4885TP53 283/4885CA2 3675/4885
US-20160296477-A1 Formulation and Process for Modulating Wound Healing SQSTM1, ATG7, TFEB APP 4260/4885TP53 375/4885CA2 3726/4885
US-20210228501-A1 Formulation and Process for Modulating Wound Healing ATG7, SQSTM1, ATF4 APP 3850/4885TP53 142/4885CA2 3785/4885
US-10426742-B2 Formulation and process for modulating wound healing SQSTM1, ATG7, TFEB APP 4010/4885TP53 283/4885CA2 3675/4885
US-20190022029-A1 Formulation and Process for Modulating Wound Healing SQSTM1, ATG7, TFEB APP 4010/4885TP53 283/4885CA2 3675/4885

“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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