SCHEMBL23923553

SCHEMBL23923553

CN(C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1)c1cccc(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.51
CTSL P07711 3/20 0.46
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
CTSB P07858 1/20 0.46
GPR139 Q6DWJ6 3/20 0.46
PYGL P06737 1/20 0.46
TMEM97 Q5BJF2 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP14 P50281 1/20 0.44
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL23923554 1.00 GLA (0.51) GLACTSLCTSSCTSKCTSB
SCHEMBL23923394 0.91 GPR139 (0.51) GLACTSLCTSSCTSKGPR139
SCHEMBL23923396 0.91 GPR139 (0.51) GLACTSLCTSSCTSKGPR139
SCHEMBL23923365 0.88 GPR139 (0.54) CTSLCTSSCTSKCTSBGPR139
SCHEMBL23923367 0.88 GPR139 (0.54) CTSLCTSSCTSKCTSBGPR139
SCHEMBL23923528 0.88 GPR139 (0.54) GPR139PYGLRAB9AMMP9MMP8
SCHEMBL23923530 0.88 GPR139 (0.54) GPR139PYGLRAB9AMMP9MMP8
SCHEMBL23923341 0.85 KMT2A (0.47) CTSLCTSSCTSKCTSBGPR139
SCHEMBL23923343 0.85 KMT2A (0.47) CTSLCTSSCTSKCTSBGPR139
SCHEMBL23923324 0.84 SLC6A9 (0.51) CTSLCTSSCTSKGPR139PYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11850247-B2 Antiviral compounds REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2023-12-26 US disclosed
US-20210322416-A1 ANTIVIRAL COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2021-10-21 US disclosed
US-20210322416-A1 ANTIVIRAL COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2021-10-21 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 (2 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-11850247-B2 Antiviral compounds ZC3HAV1, ZC3HAV1L, CD4 GLA 2940/4885CTSL 1663/4885CTSS 858/4885
US-20210322416-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, ZC3HAV1L, CD4 GLA 2940/4885CTSL 1663/4885CTSS 858/4885

“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.