SCHEMBL23269630

SCHEMBL23269630

CCOC(=O)/C(=C\N(C)C)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ MAPK1 P28482 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ APP P05067 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ MMP1 P03956 1/20 0.40
▸ MMP13 P45452 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ KEAP1 Q14145 2/20 0.39
▸ NFE2L2 Q16236 2/20 0.39
▸ PKM P14618 2/20 0.39
▸ CA12 O43570 1/20 0.39

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
SCHEMBL10324404 0.85 SMN1; SMN2 (0.63) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL10324405 0.85 SMN1; SMN2 (0.63) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL247739 0.85 KMT2A (0.47) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL247740 0.85 KMT2A (0.47) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL13936252 0.85 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KMT2ARAB9AMAPK1
SCHEMBL247857 0.85 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL247856 0.85 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL5860986 0.83 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL5860990 0.83 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL7509357 0.80 MMP1 (0.43) ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA

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
US-20210147385-A1 COMPOUNDS AND METHODS FOR TARGETING PATHOGENIC BLOOD VESSELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-05-20 — — US disclosed
WO-2021076886-A1 3-PHENYLSULPHONYL-QUINOLINE DERIVATIVES AS AGENTS FOR TREATING PATHOGENIC BLOOD VESSELS DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-04-22 — — 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-20210147385-A1 COMPOUNDS AND METHODS FOR TARGETING PATHOGENIC BLOOD VESSELS TEK, KDR, LIPG ALDH1A1 3295/4885SMN1; SMN2 1703/4885KMT2A 4795/4885

“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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