SCHEMBL19975138

SCHEMBL19975138

CC(NC(=O)c1ccccc1)C(=O)C(=O)NCC1CCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
PREP P48147 1/20 0.48
FAP Q12884 1/20 0.48
ACE P12821 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CTSS P25774 1/20 0.47
CTSK P43235 1/20 0.47
HDAC3 O15379 1/20 0.47
ALDH1A1 P00352 2/20 0.46
ROCK2 O75116 3/20 0.44
MAPK14 Q16539 1/20 0.44
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
EPHX1 P07099 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ROCK1 Q13464 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL19975210 0.97 SMN1; SMN2 (0.53) SMN1; SMN2PREPFAPACECTSL
SCHEMBL19975149 0.96 SMN1; SMN2 (0.55) SMN1; SMN2PREPFAPACECTSL
SCHEMBL21176278 0.95 PREP (0.47) SMN1; SMN2PREPFAPACECTSL
SCHEMBL19974808 0.84 ROCK2 (0.51) PREPFAPCTSLCTSSALDH1A1
SCHEMBL21183574 0.83 MAPK14 (0.50) SMN1; SMN2ALDH1A1MAPK14MEN1KMT2A
SCHEMBL21183565 0.82 RAB9A (0.47) SMN1; SMN2ALDH1A1MAPK14KDM4EMEN1
SCHEMBL19975513 0.82 CTSL (0.50) SMN1; SMN2CTSLALDH1A1MAPK14KMT2A
SCHEMBL19975530 0.82 F10 (0.52) SMN1; SMN2CTSBHDAC3ALDH1A1MAPK14
SCHEMBL19975288 0.81 ATM (0.53) CTSLROCK2MAPK14MEN1KMT2A
SCHEMBL19975568 0.81 KCNH2 (0.51) MEN1KMT2AHPGDLMNA

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 SMN1; SMN2 706/4885PREP 646/4885FAP 3258/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C SMN1; SMN2 1086/4885PREP 778/4885FAP 3422/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C SMN1; SMN2 706/4885PREP 646/4885FAP 3258/4885

“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.