SCHEMBL24996963

SCHEMBL24996963

COCCOc1cc(F)ccc1/C=C(\N=[N+]=[N-])C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.32
▸ AKT1 P31749 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32

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
SCHEMBL23170323 0.91 MAPT (0.37) MAPTKDM4EHSD17B10KMT2A
SCHEMBL29812874 0.91 MAPT (0.37) MAPTKDM4EHSD17B10KMT2A
SCHEMBL23147888 0.90 KDM4E (0.33) ALDH1A1MAPTKDM4EHTTHSD17B10
SCHEMBL24113246 0.86 CTSL (0.38) MAPTHTTKMT2A
SCHEMBL30310695 0.86 CTSL (0.38) MAPTHTTKMT2A
SCHEMBL24996986 0.82 ALDH1A1 (0.38) ALDH1A1CA12CA1CA2CA9
SCHEMBL24997201 0.80 AXL (0.38) ALDH1A1MAPTKDM4EHTTHSD17B10
SCHEMBL24113139 0.79 CA1 (0.39) MAPTHTTHPGDCA12CA1
SCHEMBL22620771 0.79 MAPT (0.33) ALDH1A1MAPTKDM4EHPGDCA12
SCHEMBL30008568 0.79 CA1 (0.39) MAPTHTTHPGDCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230040909-A1 INDOLE CARBOXAMIDE COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT INC (US) 2023-02-09 — — 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 (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-20230040909-A1 INDOLE CARBOXAMIDE COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS IDO1, IDO2, INMT ALDH1A1 477/4885MAPT 960/4885KDM4E 1303/4885

“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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