SCHEMBL19974797

SCHEMBL19974797

Cc1cc(C(=O)N(C)C(C)C(O)C(=O)NCC2CCCCC2)no1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 5/20 0.48
GAA P10253 2/20 0.48
KLK7 P49862 3/20 0.42
ALDH1A1 P00352 2/20 0.42
S1PR1 P21453 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.37
XBP1 P17861 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL21176286 0.82 S1PR3 (0.49) S1PR3GAAKLK7ALDH1A1S1PR1
SCHEMBL19975216 0.75 SMN1; SMN2 (0.44) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL19975309 0.74 SMN1; SMN2 (0.44) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL19974966 0.74 SMN1; SMN2 (0.44) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL19974913 0.71 EPHX1 (0.43) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL19974820 0.71 PTGIR (0.42) GAAALDH1A1SMN1; SMN2L3MBTL1TSHR
SCHEMBL19974824 0.71 SMN1; SMN2 (0.41) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL13631421 0.69 HIF1A (0.60) GAAALDH1A1TSHR
SCHEMBL19975197 0.68 TDP1 (0.37) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL19975438 0.67 SMN1; SMN2 (0.43) GAAALDH1A1SMN1; SMN2L3MBTL1TDP1

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 S1PR3 1257/4885GAA 75/4885KLK7 3664/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C S1PR3 1437/4885GAA 107/4885KLK7 3632/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C S1PR3 1257/4885GAA 75/4885KLK7 3664/4885

“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.