SCHEMBL23748854

SCHEMBL23748854

CCCCCCCCCCCCC(CCl)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.59
GRIK2 Q13002 2/20 0.59
CA2 P00918 2/20 0.57
MAPK1 P28482 1/20 0.57
SLC1A2 P43004 2/20 0.56
SLC1A1 P43005 2/20 0.56
GPR84 Q9NQS5 7/20 0.55
FFAR1 O14842 1/20 0.55
MAPT P10636 1/20 0.53
LCK P06239 1/20 0.53
PPARD Q03181 1/20 0.53
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
ACE2 Q9BYF1 1/20 0.50
SLC1A3 P43003 1/20 0.48
CHRM1 P11229 1/20 0.48
AKR1A1 P14550 1/20 0.48
CHRM3 P20309 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48

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
SCHEMBL28289743 1.00 GRIK1 (0.59) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL10561890 1.00 GRIK1 (0.59) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL28704278 1.00 GRIK1 (0.59) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL11758553 1.00 GRIK1 (0.59) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL6951709 1.00 GRIK1 (0.59) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL10639150 0.91 CA2 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL21435014 0.89 TERT (0.51) GRIK1GRIK2FFAR1MAPTPPARD
SCHEMBL25292827 0.87 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25286597 0.87 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25292674 0.87 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030868-B2 Prodrugs of CGRP antagonists PFIZER IRELAND PHARMACEUTICALS (IE) 2024-07-09 US disclosed
US-20210395223-A1 PRODRUGS OF CGRP ANTAGONISTS PFIZER IRELAND PHARMACEUTICALS (IE) 2021-12-23 US disclosed
EP-3863629-A1 PRODRUGS OF CGRP ANTAGONISTS Biohaven Pharmaceutical Holding Company Ltd. (US) 2021-08-18 EP 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 (2 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-20210395223-A1 PRODRUGS OF CGRP ANTAGONISTS CALCRL, CALCA, CALCB GRIK1 586/4885GRIK2 620/4885CA2 1713/4885
US-12030868-B2 Prodrugs of CGRP antagonists CALCRL, CALCA, CALCB GRIK1 586/4885GRIK2 620/4885CA2 1713/4885

“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.