SCHEMBL15867482

SCHEMBL15867482

CCC(=O)[C@H](Cn1cccn1)NC(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.42
NLRP3 Q96P20 2/20 0.41
TSHR P16473 2/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
THRB P10828 2/20 0.34
LMNA P02545 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RORC P51449 1/20 0.32
KCNH2 Q12809 1/20 0.32
OPRD1 P41143 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL304552 0.87 FDPS (0.43) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL14864693 0.87 FDPS (0.43) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL304551 0.87 FDPS (0.43) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL888803 0.84 FDPS (0.41) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL10122821 0.84 FDPS (0.41) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL8908145 0.83 NLRP3 (0.42) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL15867490 0.81 FDPS (0.45) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL14864790 0.81 FDPS (0.45) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL13179092 0.78 FDPS (0.43) FDPSNLRP3TSHRHDAC1HDAC6
SCHEMBL13748277 0.77 FDPS (0.42) FDPSNLRP3TSHRHDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140193363-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-07-10 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-20140193363-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 FDPS 868/4885NLRP3 3035/4885TSHR 4648/4885

“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.