SCHEMBL19975068

SCHEMBL19975068

CC(C(=O)C(=O)NCC1CC1)N(C=O)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.43
CXCR3 P49682 4/20 0.42
SIGMAR1 Q99720 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ACHE P22303 2/20 0.40
NAPEPLD Q6IQ20 2/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAOA P21397 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL21176355 0.95 SMN1; SMN2 (0.44) PTGESCXCR3SMN1; SMN2ALDH1A1GAA
SCHEMBL19974922 0.95 SMN1; SMN2 (0.47) PTGESCXCR3SMN1; SMN2ALDH1A1GAA
SCHEMBL21183555 0.84 PTGES (0.42) PTGESCXCR3ACHENAPEPLDMAOA
SCHEMBL19974919 0.82 RAB9A (0.42) PTGESSMN1; SMN2ALDH1A1L3MBTL1KMT2A
SCHEMBL19975258 0.82 KMT2A (0.55) SMN1; SMN2ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL21176277 0.81 PTGIR (0.41) SIGMAR1ACHEMAOA
SCHEMBL19975365 0.81 CXCR3 (0.42) PTGESCXCR3SMN1; SMN2ALDH1A1ACHE
SCHEMBL21176191 0.81 CXCR3 (0.43) PTGESCXCR3SIGMAR1SMN1; SMN2ALDH1A1
SCHEMBL19974757 0.81 SMN1; SMN2 (0.42) PTGESCXCR3SIGMAR1SMN1; SMN2ALDH1A1
SCHEMBL19974924 0.80 NAPEPLD (0.40) PTGESCXCR3ALDH1A1NAPEPLDKDM4E

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 PTGES 138/4885CXCR3 430/4885SIGMAR1 1966/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C PTGES 149/4885CXCR3 637/4885SIGMAR1 2229/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C PTGES 138/4885CXCR3 430/4885SIGMAR1 1966/4885

“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.