SCHEMBL21245504

SCHEMBL21245504

CCCCCCCC(C)CCC(CN)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.66
GRIK1 P39086 2/20 0.51
GRIK2 Q13002 2/20 0.51
SLC1A2 P43004 2/20 0.49
SLC1A1 P43005 2/20 0.49
GPR84 Q9NQS5 6/20 0.47
FFAR1 O14842 1/20 0.47
MAPT P10636 1/20 0.46
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
CA2 P00918 2/20 0.44
MAPK1 P28482 1/20 0.44
SLC1A3 P43003 1/20 0.42
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 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
SCHEMBL21245488 1.00 ACE2 (0.66) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL21245498 0.98 ACE2 (0.62) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL3995094 0.93 ACE2 (0.55) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL4001193 0.93 ACE2 (0.55) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL400264 0.87 GRIK1 (0.65) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL21122315 0.87 GRIK1 (0.65) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL7717787 0.87 GRIK1 (0.65) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL10804881 0.87 GRIK1 (0.65) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL3992111 0.86 ACE2 (0.56) ACE2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL3995620 0.86 ACE2 (0.56) ACE2GRIK1GRIK2SLC1A2SLC1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250127733-A1 TOXIC ALDEHYDE RELATED DISEASES AND TREATMENT ALDEYRA THERAPEUTICS, INC. 2025-04-24 US disclosed
US-11701331-B2 Toxic aldehyde related diseases and treatment ALDEYRA THERAPEUTICS, INC. (US) 2023-07-18 US disclosed
US-20210275469-A1 TOXIC ALDEHYDE RELATED DISEASES AND TREATMENT ALDEYRA THERAPEUTICS, INC. 2021-09-09 US disclosed
US-11007157-B2 Toxic aldehyde related diseases and treatment ALDEYRA THERAPEUTICS, INC. (US) 2021-05-18 US disclosed
US-10588874-B2 Toxic aldehyde related diseases and treatment ALDEYRA THERAPEUTICS, INC. (US) 2020-03-17 US disclosed
US-20190247334-A1 TOXIC ALDEHYDE RELATED DISEASES AND TREATMENT ALDEXA THERAPEUTICS, INC. 2019-08-15 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 (6 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-20210275469-A1 TOXIC ALDEHYDE RELATED DISEASES AND TREATMENT ALDH1A2, ALDH2, ALDH1A1 ACE2 390/4885GRIK1 1329/4885GRIK2 1664/4885
US-20190247334-A1 TOXIC ALDEHYDE RELATED DISEASES AND TREATMENT ALDH1A2, ALDH2, ALDH1A1 ACE2 390/4885GRIK1 1329/4885GRIK2 1664/4885
US-11007157-B2 Toxic aldehyde related diseases and treatment ALDH1A2, ALDH2, ALDH1A1 ACE2 390/4885GRIK1 1329/4885GRIK2 1664/4885
US-10588874-B2 Toxic aldehyde related diseases and treatment ALDH1A2, ALDH2, ALDH1A1 ACE2 390/4885GRIK1 1329/4885GRIK2 1664/4885
US-20250127733-A1 TOXIC ALDEHYDE RELATED DISEASES AND TREATMENT ALDH1A2, ALDH2, ALDH1A1 ACE2 390/4885GRIK1 1329/4885GRIK2 1664/4885
US-11701331-B2 Toxic aldehyde related diseases and treatment ALDH1A2, ALDH2, ALDH1A1 ACE2 390/4885GRIK1 1329/4885GRIK2 1664/4885

“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.