SCHEMBL19974854

SCHEMBL19974854

CCCC(NC(=O)c1ccccc1)C(O)C(=O)NCC1CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 1/20 0.45
BACE1 P56817 4/20 0.45
BACE2 Q9Y5Z0 4/20 0.45
CTSL P07711 2/20 0.45
CTSB P07858 2/20 0.45
CTSK P43235 2/20 0.45
CTSS P25774 1/20 0.45
F10 P00742 7/20 0.44
PRSS1 P07477 6/20 0.44
F2 P00734 1/20 0.44
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CTSG P08311 1/20 0.42
CTRB1 P17538 1/20 0.42
CMA1 P23946 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 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
SCHEMBL19975371 0.90 CTSL (0.46) BACE1BACE2CTSLCTSBCTSK
SCHEMBL19974933 0.83 MEN1 (0.53) GPR88BACE1BACE2CTSLCTSB
SCHEMBL19975275 0.83 F10 (0.47) CTSLCTSBCTSKCTSSF10
SCHEMBL19975200 0.81 F10 (0.48) CTSLCTSBCTSKCTSSF10
SCHEMBL19974771 0.79 KMT2A (0.47) GPR88SMN1; SMN2
SCHEMBL19975354 0.78 ALDH1A1 (0.53) CTSLCTSBCTSKCTSSF10
SCHEMBL19974729 0.78 ALDH1A1 (0.50) CTSLCTSBCTSKCTSSF10
SCHEMBL21176167 0.77 ALDH1A1 (0.55) CTSLCTSBCTSKCTSSSMN1; SMN2
SCHEMBL19975283 0.77 CCR1 (0.49) CTSLCTSBCTSKCTSSF10
SCHEMBL19975388 0.75 PRSS1 (0.50) PRSS1NPC1RAB9ACTSGCTRB1

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 GPR88 1894/4885BACE1 1733/4885BACE2 2217/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C GPR88 2316/4885BACE1 2329/4885BACE2 2289/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C GPR88 1894/4885BACE1 1733/4885BACE2 2217/4885

“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.