SCHEMBL19731928

SCHEMBL19731928

CNc1cccc(-c2ccc3c(c2)OCCO3)c1C#N

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 14/20 0.63
PDCD1 Q15116 12/20 0.63
ADORA1 P30542 2/20 0.46
MAPT P10636 2/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
BCL2L1 Q07817 1/20 0.41

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
SCHEMBL25059947 0.86 CD274 (0.47) CD274PDCD1ADORA1
SCHEMBL23805188 0.81 CD274 (0.60) CD274PDCD1NPC1
SCHEMBL30093825 0.81 CD274 (0.60) CD274PDCD1NPC1
SCHEMBL18979829 0.80 CD274 (0.67) CD274PDCD1ADORA1MAPTALOX15
SCHEMBL18792069 0.80 CD274 (0.67) CD274PDCD1ADORA1MAPTALOX15
SCHEMBL31644196 0.80 CD274 (0.67) CD274PDCD1ADORA1MAPTALOX15
SCHEMBL18727806 0.80 CD274 (0.67) CD274PDCD1ADORA1MAPTALOX15
SCHEMBL25060039 0.80 CD274 (0.52) CD274PDCD1MAPTNPC1ALDH1A1
SCHEMBL25059948 0.80 CD274 (0.59) CD274PDCD1
SCHEMBL29894237 0.77 CD274 (0.64) CD274PDCD1ADORA1MAPTALOX15

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-4137489-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS Incyte Corporation (US) 2023-02-22 EP disclosed
EP-3504198-B1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORP (US) 2023-01-25 EP disclosed
WO-2018044783-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION (US) 2018-03-08 WO disclosed
US-20170362253-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION 2017-12-21 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 (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-20170362253-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS CD74, IL2, ICOS CD274 88/4885PDCD1 157/4885ADORA1 1316/4885

“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.