SCHEMBL20098073

SCHEMBL20098073

CCCCCCC(CCCC)c1ncco1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.41
CES1 P23141 1/20 0.41
DNM1 Q05193 2/20 0.33
SLC2A1 P11166 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
NR1I2 O75469 1/20 0.33
ADA P00813 2/20 0.32

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
SCHEMBL18934142 0.98 FAAH (0.42) FAAHCES1SLC2A1GPR84NR1I2
SCHEMBL22166109 0.98 FAAH (0.42) FAAHCES1SLC2A1GPR84NR1I2
SCHEMBL22692970 0.98 FAAH (0.42) FAAHCES1SLC2A1GPR84NR1I2
SCHEMBL20893257 0.98 FAAH (0.42) FAAHCES1SLC2A1GPR84NR1I2
SCHEMBL27336909 0.95 FAAH (0.38) FAAHCES1
SCHEMBL19852979 0.92 FAAH (0.40) FAAHCES1SLC2A1GPR84NR1I2
SCHEMBL26646458 0.88 FAAH (0.36) FAAHCES1NR1I2
SCHEMBL6922325 0.87 FAAH (0.40) FAAHCES1
SCHEMBL20612594 0.83 FAAH (0.33) FAAHCES1
SCHEMBL26646510 0.79 FAAH (0.37) FAAHCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752598-B2 Aryldiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-08-25 US disclosed
US-10696713-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2020-06-30 US disclosed
US-20190194245-A1 BILE ACID DERIVATIVES AS FXR/TGR5 AGONISTS AND METHODS OF USE THEREOF ENANTA PHARM INC (US) 2019-06-27 US disclosed
US-9957281-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2018-05-01 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-10696713-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof GPBAR1, NR1H4, SLC10A1 FAAH 603/4885CES1 56/4885DNM1 2185/4885
US-20190194245-A1 BILE ACID DERIVATIVES AS FXR/TGR5 AGONISTS AND METHODS OF USE THEREOF GPBAR1, NR1H4, SLC10A1 FAAH 603/4885CES1 56/4885DNM1 2185/4885
US-10752598-B2 Aryldiazepine derivatives as RSV inhibitors AHR, FURIN, CYP3A5 FAAH 133/4885CES1 564/4885DNM1 1577/4885

“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.