SCHEMBL17817620

SCHEMBL17817620

CCCCCCCCCCCCCCCCCCNC(=O)CCN

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.74
NAAA Q02083 1/20 0.69
SLC6A5 Q9Y345 2/20 0.66
FAAH O00519 4/20 0.59
EPHX1 P07099 5/20 0.57
DNM1 Q05193 1/20 0.56
HPGD P15428 1/20 0.56
RRM1 P23921 1/20 0.54
EPHX2 P34913 2/20 0.54

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
SCHEMBL24412649 1.00 CASP2 (0.74) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL27836368 1.00 CASP2 (0.74) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL28688783 1.00 CASP2 (0.74) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL13019125 1.00 CASP2 (0.74) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL11739321 1.00 CASP2 (0.74) CASP2NAAASLC6A5FAAHEPHX1
Hydrochloric Acid SCHEMBL20542987 0.98 CASP2 (0.71) CASP2NAAASLC6A5FAAHEPHX1
Hydrochloric Acid SCHEMBL23000981 0.98 CASP2 (0.71) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL7700850 0.98 CASP2 (0.70) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL3550215 0.92 CASP2 (0.61) CASP2NAAASLC6A5FAAHEPHX1
SCHEMBL22522082 0.90 SLC6A5 (0.64) CASP2NAAASLC6A5FAAHDNM1

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
WO-2021252290-A2 COMPOSITIONS AND METHODS FOR TREATING NOVEL CORONAVIRUS SARS-COV-2-MEDIATED INFLAMMATORY CONDITIONS GRI BIO, INC. (US) 2021-12-16 WO disclosed
EP-3229811-B1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS GRI BIO INC (US) 2021-02-24 EP disclosed
EP-3229811-B1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS GRI BIO INC (US) 2021-02-24 EP disclosed
WO-2016094226-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS GLYCOREGIMMUNE, INC. (US) 2016-06-16 WO disclosed
US-20160158258-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS ALTIUM GROWTH FUND, LP 2016-06-09 US disclosed
CN-1059658-A The method of stabilized liposome and the compositions that contains them JOHNSON & SON INC S C (US) 1992-03-25 CN 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-20160158258-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS RXRA, RXRG, CX3CR1 CASP2 248/4885NAAA 2859/4885SLC6A5 4866/4885

“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.