SCHEMBL20701416

SCHEMBL20701416

CC(C)(C)OC(=O)NCC(=O)N1C(=O)N(C(=O)OCc2ccccc2)C[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.46
SIGMAR1 Q99720 1/20 0.44
CTSL P07711 1/20 0.42
SYK P43405 1/20 0.42
NPFFR1 Q9GZQ6 1/20 0.39
NPFFR2 Q9Y5X5 1/20 0.39
HTT P42858 1/20 0.39
HTR2C P28335 1/20 0.38
PREP P48147 2/20 0.38

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
SCHEMBL20701420 1.00 FKBP1A (0.46) FKBP1ASIGMAR1CTSLSYKNPFFR1
SCHEMBL20701308 0.93 SIGMAR1 (0.45) FKBP1ASIGMAR1CTSLSYKNPFFR1
SCHEMBL20701304 0.93 SIGMAR1 (0.45) FKBP1ASIGMAR1CTSLSYKNPFFR1
SCHEMBL15122636 0.84 HPGD (0.45) FKBP1ACTSLHTR2C
SCHEMBL15122638 0.84 HPGD (0.45) FKBP1ACTSLHTR2C
SCHEMBL31148977 0.80 HTT (0.43) FKBP1ACTSLHTTHTR2C
SCHEMBL30428928 0.80 HPGD (0.43) FKBP1ACTSLHTTHTR2C
SCHEMBL14814073 0.77 NPC1 (0.44) FKBP1ACTSLHTR2C
SCHEMBL1997238 0.77 FKBP1A (0.64) FKBP1ASIGMAR1CTSLPREP
SCHEMBL6787227 0.77 FKBP1A (0.64) FKBP1ASIGMAR1CTSLPREP

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
EP-3186270-B1 CYCLIC UREA COMPOUNDS AS GRANZYME B INHIBITORS VIDA THERAPEUTICS INC (CA) 2020-02-19 EP disclosed
US-10537652-B2 Cyclic urea compounds as granzyme B inhibitors VIDA THERAPEUTICS INC. (CA) 2020-01-21 US disclosed
US-20190151484-A2 CYCLIC UREA COMPOUNDS AS GRANZYME B INHIBITORS VIDA THERAPEUTICS INC. (CA) 2019-05-23 US disclosed
US-20190038602-A1 GRANZYME B INHIBITOR FORMULATIONS AND METHODS FOR THE TREATMENT OF BURNS VIDA THERAPEUTICS, INC. (CA) 2019-02-07 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-20190038602-A1 GRANZYME B INHIBITOR FORMULATIONS AND METHODS FOR THE TREATMENT OF BURNS GZMB, CTSB, SERPINB1 FKBP1A 1088/4885SIGMAR1 4267/4885CTSL 36/4885

“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.