SCHEMBL19244992

SCHEMBL19244992

O=C(OCc1ccccc1)[C@@H](O)CCc1ccc(C2=CCOCC2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 12/20 0.37
MAPK1 P28482 1/20 0.35
S1PR5 Q9H228 1/20 0.34
BRD4 O60885 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
IDH2 P48735 1/20 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
SCHEMBL19088678 0.90 PTGDR2 (0.38) PTGDR2MAPK1S1PR5MEN1KMT2A
SCHEMBL29541695 0.90 PTGDR2 (0.38) PTGDR2MAPK1S1PR5MEN1KMT2A
SCHEMBL18248027 0.90 PTGDR2 (0.38) PTGDR2MAPK1S1PR5MEN1KMT2A
SCHEMBL19244971 0.86 IDH2 (0.34) MAPK1BRD4IDH2
SCHEMBL22502752 0.85 PTGDR2 (0.39) PTGDR2MAPK1S1PR5MAPTNPC1
SCHEMBL21159519 0.85 BRD4 (0.41) MAPK1BRD4MEN1KMT2ANPSR1
SCHEMBL18248125 0.80 PTGDR2 (0.38) PTGDR2MAPK1S1PR5BRD4MEN1
SCHEMBL29551590 0.77 KDM6B (0.42) MAPK1IDH2
SCHEMBL19088504 0.77 KDM6B (0.42) MAPK1IDH2
SCHEMBL18248029 0.77 KDM6B (0.42) MAPK1IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018048-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2024-06-25 US disclosed
US-11382949-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2022-07-12 US disclosed
US-20220098241-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2022-03-31 US disclosed
US-11230571-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2022-01-25 US disclosed
US-20200354408-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2020-11-12 US disclosed
US-20190307838-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2019-10-10 US disclosed
US-20190248840-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2019-08-15 US disclosed
US-10344056-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2019-07-09 US disclosed
US-20170233438-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS MERIAL INC. (US) 2017-08-17 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 (9 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-10344056-B2 Anthelmintic depsipeptide compounds VIP, PREP, DNPEP PTGDR2 2747/4885MAPK1 2977/4885S1PR5 1829/4885
US-12018048-B2 Anthelmintic depsipeptide compounds VIP, DNPEP, DPEP1 PTGDR2 2422/4885MAPK1 2736/4885S1PR5 2580/4885
US-11382949-B2 Anthelmintic depsipeptide compounds ENPP2, ROCK2, RRP12 PTGDR2 142/4885MAPK1 1749/4885S1PR5 1195/4885
US-20170233438-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP PTGDR2 2747/4885MAPK1 2977/4885S1PR5 1829/4885
US-20220098241-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP PTGDR2 2747/4885MAPK1 2977/4885S1PR5 1829/4885
US-20190248840-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP PTGDR2 2747/4885MAPK1 2977/4885S1PR5 1829/4885
US-20190307838-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS ENPP2, ROCK2, RRP12 PTGDR2 142/4885MAPK1 1749/4885S1PR5 1195/4885
US-20200354408-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP PTGDR2 2957/4885MAPK1 3054/4885S1PR5 1978/4885
US-11230571-B2 Anthelmintic depsipeptide compounds VIP, PREP, DNPEP PTGDR2 2747/4885MAPK1 2977/4885S1PR5 1829/4885

“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.