SCHEMBL21176392

SCHEMBL21176392

CC(C)C(C(=O)C(=O)NCC1CC1)N(C=O)CC1CCOCC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CTSD P07339 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PIK3CD O00329 1/20 0.30
HTR4 Q13639 1/20 0.30

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
SCHEMBL19975147 0.83 CTSD (0.33) NPC1RAB9AKDM4ECTSDPIK3CD
SCHEMBL19974996 0.82 CTSD (0.38) NPC1RAB9ACTSDTDP1
SCHEMBL21183525 0.81 TDP1 (0.31) NPC1RAB9ATDP1
SCHEMBL19975158 0.81 KDM4E (0.32) NPC1RAB9AKDM4ECTSD
SCHEMBL19975101 0.81 NPC1 (0.31) NPC1RAB9A
SCHEMBL19975385 0.81 TDP1 (0.34) RAB9ATDP1
SCHEMBL21176350 0.79 KMT2A (0.33) TDP1
SCHEMBL19974702 0.79 KMT2A (0.33) TDP1
SCHEMBL19975146 0.79 KMT2A (0.33) TDP1
SCHEMBL21183563 0.77 CTSD (0.31) CTSD

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 5 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

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 NPC1 753/4885RAB9A 1576/4885KDM4E 3330/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C NPC1 1213/4885RAB9A 1334/4885KDM4E 3784/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C NPC1 753/4885RAB9A 1576/4885KDM4E 3330/4885

“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.