SCHEMBL19974734

SCHEMBL19974734

COc1ccccc1S(=O)(=O)NC(C)C(O)C(=O)NCC1CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 2/20 0.47
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 2/20 0.43
ATM Q13315 1/20 0.43
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 1/20 0.39
NAMPT P43490 1/20 0.39
ACACB O00763 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
SCHEMBL19974832 0.85 ITGAV (0.44) ITGAVKMT2AALDH1A1MEN1MAPT
SCHEMBL19975243 0.84 KMT2A (0.45) ITGAVKMT2AALDH1A1MEN1MAPT
SCHEMBL19975337 0.82 KMT2A (0.54) KMT2AALDH1A1HPGDHSD17B10MEN1
SCHEMBL19974751 0.81 ITGAV (0.47) ITGAVKMT2AALDH1A1HPGDHSD17B10
SCHEMBL19975412 0.78 HPGD (0.49) KMT2AALDH1A1HPGDMEN1MAPT
SCHEMBL19974908 0.77 KMT2A (0.52) KMT2AALDH1A1HPGDMEN1
SCHEMBL19975436 0.76 KMT2A (0.48) KMT2AALDH1A1MEN1SMN1; SMN2GAA
SCHEMBL19974744 0.76 KMT2A (0.64) KMT2AALDH1A1HPGDHSD17B10MEN1
SCHEMBL19975189 0.76 HPGD (0.58) KMT2AALDH1A1HPGDMEN1MAPT
SCHEMBL21176298 0.75 KMT2A (0.52) KMT2AALDH1A1MEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220356148-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2022-11-10 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
EP-3512836-A1 ANTIVIRAL COMPOUNDS Haplogen GmbH (AT) 2019-07-24 EP disclosed
WO-2018050631-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2018-03-22 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 (3 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-20190225575-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G12A, PLA2G4C ITGAV 3285/4885KMT2A 4031/4885ALDH1A1 2271/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C ITGAV 3373/4885KMT2A 4177/4885ALDH1A1 2673/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C ITGAV 3285/4885KMT2A 4031/4885ALDH1A1 2271/4885

“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.