SCHEMBL19974820

SCHEMBL19974820

CC(C(O)C(=O)NCC1CC1)N(C)C(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.42
MAOA P21397 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HDAC3 O15379 1/20 0.40
F10 P00742 4/20 0.39
PRSS1 P07477 2/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM1A O60341 1/20 0.39
RCOR1 Q9UKL0 1/20 0.39
BCHE P06276 3/20 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
SCHEMBL19975178 0.79 PTGIR (0.43) PTGIRMAOASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL19975045 0.78 KMT2A (0.42) PTGIRALDH1A1HPGDGAAL3MBTL1
SCHEMBL19975274 0.78 PTGIR (0.41) PTGIRALDH1A1F10PRSS1GAA
SCHEMBL19975197 0.77 TDP1 (0.37) PTGIRSMN1; SMN2ALDH1A1CYP3A4HPGD
SCHEMBL19975275 0.77 F10 (0.47) SMN1; SMN2ALDH1A1HDAC3F10PRSS1
SCHEMBL28316851 0.76 USP2 (0.41) SMN1; SMN2ALDH1A1CYP3A4HPGDTSHR
SCHEMBL19975233 0.76 POLB (0.50) PTGIRSMN1; SMN2ALDH1A1CYP3A4TSHR
SCHEMBL19975037 0.75 SIGMAR1 (0.48) SMN1; SMN2ALDH1A1CYP3A4HPGDTSHR
SCHEMBL19975200 0.75 F10 (0.48) SMN1; SMN2ALDH1A1CYP3A4HPGDTSHR
SCHEMBL19974757 0.75 SMN1; SMN2 (0.42) MAOASMN1; SMN2ALDH1A1CYP3A4HPGD

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 PTGIR 540/4885MAOA 1107/4885SMN1; SMN2 706/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C PTGIR 679/4885MAOA 990/4885SMN1; SMN2 1086/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C PTGIR 540/4885MAOA 1107/4885SMN1; SMN2 706/4885

“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.