SCHEMBL16384292

SCHEMBL16384292

CCCC(=O)NCCCCNC

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.73
NAAA Q02083 1/20 0.57
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
FAAH O00519 3/20 0.48
EPHX1 P07099 2/20 0.46
HPGD P15428 1/20 0.46
DNM1 Q05193 1/20 0.46
GPR84 Q9NQS5 1/20 0.45
LPAR1 Q92633 1/20 0.45

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
SCHEMBL19880209 0.98 CASP2 (0.77) CASP2NAAAMEN1KMT2AFAAH
SCHEMBL17070055 0.98 CASP2 (0.77) CASP2NAAAMEN1KMT2AFAAH
SCHEMBL23288384 0.96 CASP2 (0.67) CASP2NAAAMEN1KMT2AFAAH
SCHEMBL7537764 0.91 CASP2 (0.86) CASP2NAAAMEN1KMT2AFAAH
SCHEMBL14199967 0.89 CASP2 (0.91) CASP2NAAAMEN1KMT2AFAAH
SCHEMBL22623202 0.88 CASP2 (0.68) CASP2NAAAFAAHEPHX1HPGD
SCHEMBL19248862 0.88 CASP2 (0.68) CASP2NAAAFAAHEPHX1DNM1
SCHEMBL19249062 0.88 CASP2 (0.68) CASP2NAAAFAAHEPHX1DNM1
SCHEMBL25091844 0.88 CASP2 (0.68) CASP2NAAAMEN1KMT2AFAAH
SCHEMBL12583601 0.86 CASP2 (0.59) CASP2NAAAMEN1KMT2AFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3549934-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene CAR LLC (BM) 2019-10-09 EP disclosed
US-20150005319-A1 MACROCYCLIC COMPOUNDS FOR MODULATING IL-17 ENSEMBLE THERAPEUTICS CORPORATION 2015-01-01 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 (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-20150005319-A1 MACROCYCLIC COMPOUNDS FOR MODULATING IL-17 IL17A, IL15, IL2 CASP2 629/4885NAAA 4744/4885MEN1 1132/4885

“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.