SCHEMBL3315518

SCHEMBL3315518

CCCCCCCCCCCCCCCCC(CCN(CC)CC)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.53
GRIK2 Q13002 2/20 0.53
CA2 P00918 2/20 0.50
SLC1A2 P43004 2/20 0.50
SLC1A1 P43005 2/20 0.50
MAPK1 P28482 1/20 0.50
GPR84 Q9NQS5 5/20 0.48
FFAR1 O14842 1/20 0.48
MAPT P10636 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
CHRM1 P11229 1/20 0.47
AKR1A1 P14550 1/20 0.47
CHRM3 P20309 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
ADRA1A P35348 1/20 0.47
HRH1 P35367 1/20 0.47

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
SCHEMBL10357849 0.93 CA2 (0.59) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL8589490 0.85 CA2 (0.59) GRIK1GRIK2CA2SLC1A2SLC1A1
Diethylamine SCHEMBL31305857 0.85 CA2 (0.50) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25292674 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25295689 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25292827 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25286591 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25295583 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25294227 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1
SCHEMBL25292005 0.84 GRIK1 (0.68) GRIK1GRIK2CA2SLC1A2SLC1A1

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
EP-0705094-B1 SKIN AND SCALP BARRIER FOR USE WITH HAIR TREATMENT PRODUCTS CARSON PROD CO (US) 2000-05-24 EP claimed
CN-113924357-A Bifidobacterium longum strain or cosmetic composition containing the same 株式会社爱托健 2022-01-11 CN disclosed
US-8420589-B2 Composition for textile softener having low temperature activity and textile softener sheet comprising the same LG HOUSEHOLD & HEALTH CARE LTD (KR) 2013-04-16 US disclosed
US-20120309668-A1 COMPOSITION FOR TEXTILE SOFTENER HAVING LOW TEMPERATURE ACTIVITY AND TEXTILE SOFTENER SHEET COMPRISING THE SAME LG HOUSEHOLD & HEALTH CARE LTD. (KR) 2012-12-06 US disclosed
US-20100113325-A1 COMPOSITION FOR TEXTILE SOFTENER HAVING LOW TEMPERATURE ACTIVITY AND TEXTILE SOFTENER SHEET COMPRISING THE SAME LG HOUSEHOLD & HEALTH CARE LTD. (KR) 2010-05-06 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 (1 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-20100113325-A1 COMPOSITION FOR TEXTILE SOFTENER HAVING LOW TEMPERATURE ACTIVITY AND TEXTILE SOFTENER SHEET COMPRISING THE SAME CTRC, C9, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 GRIK1 2787/4885GRIK2 3808/4885CA2 3609/4885

“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.