SCHEMBL24844947

SCHEMBL24844947

CC1=C(Cc2cccnc2)C(=O)c2ccccc2C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 3/20 1.00
▸ RAB9A P51151 3/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ APAF1 O14727 2/20 0.47
▸ HK1 P19367 1/20 0.47
▸ HKDC1 Q2TB90 1/20 0.47
▸ MAPK10 P53779 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CHRM2 P08172 3/20 0.45
▸ CHRM4 P08173 3/20 0.45
▸ CHRM5 P08912 3/20 0.45
▸ CHRM1 P11229 3/20 0.45
▸ CHRM3 P20309 3/20 0.45
▸ TP53 P04637 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ HTT P42858 2/20 0.43

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
SCHEMBL29747247 0.86 TBXAS1 (0.75) TBXAS1TDP1L3MBTL1
SCHEMBL2715544 0.86 TBXAS1 (0.75) TBXAS1TDP1L3MBTL1
SCHEMBL31127526 0.84 TBXAS1 (0.73) TBXAS1RAB9AKMT2AAPAF1HKDC1
Hydrochloric Acid SCHEMBL594558 0.84 TBXAS1 (0.73) TBXAS1TDP1L3MBTL1
SCHEMBL15698107 0.83 TBXAS1 (0.70) TBXAS1RAB9AKMT2AAPAF1HKDC1
SCHEMBL7912380 0.82 TBXAS1 (0.69) TBXAS1RAB9AKMT2AAPAF1HKDC1
SCHEMBL16067092 0.81 TBXAS1 (0.68) TBXAS1ALDH1A1MAPTHTTLMNA
SCHEMBL5810540 0.78 TBXAS1 (0.62) TBXAS1RAB9AKMT2AAPAF1ALDH1A1
SCHEMBL30106700 0.77 TBXAS1 (0.62) TBXAS1RAB9AKMT2AAPAF1HKDC1
SCHEMBL30106669 0.77 TBXAS1 (0.62) TBXAS1RAB9AKMT2AAPAF1HKDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3983385-B1 NAPHTHOQUINONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS PTC THERAPEUTICS INC (US) 2023-08-30 — — EP disclosed
US-20230002324-A1 NAPHTHOQUINONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS PTC THERAPEUTICS, INC. 2023-01-05 — — 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-20230002324-A1 NAPHTHOQUINONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS NFE2L2, AIFM2, GPX4 TBXAS1 924/4885RAB9A 1357/4885KMT2A 3294/4885

“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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