SCHEMBL21117290

SCHEMBL21117290

O=C1NC2=CCCC=C2C(c2ccccc2)=NC1Nc1nnc(-c2ccnc(F)c2)o1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 5/20 0.38
FPR1 P21462 2/20 0.38
ACHE P22303 3/20 0.33
CDC7 O00311 2/20 0.32
CCNE1 P24864 2/20 0.32
CDK2 P24941 2/20 0.32
DBF4 Q9UBU7 2/20 0.32
ROCK2 O75116 1/20 0.32
GPR65 Q8IYL9 1/20 0.31
HDAC1 Q13547 1/20 0.31
BCHE P06276 1/20 0.31
BUB1 O43683 1/20 0.30
CCKAR P32238 1/20 0.30
CCKBR P32239 1/20 0.30

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
SCHEMBL21117299 0.84 FPR2 (0.37) FPR2FPR1CDC7CCNE1CDK2
SCHEMBL20098133 0.82 CCKBR (0.47) CCKARCCKBR
SCHEMBL21755262 0.82 CCKBR (0.47) CCKARCCKBR
SCHEMBL21117574 0.78 FPR2 (0.39) FPR2FPR1
SCHEMBL21117554 0.72 TUBB4A (0.35) CCKARCCKBR
SCHEMBL20098125 0.71 CCKBR (0.52) CCKARCCKBR
SCHEMBL21755182 0.71 CCKBR (0.52) CCKARCCKBR
SCHEMBL21755214 0.71 CCKBR (0.48) CCKARCCKBR
SCHEMBL20098152 0.71 CCKBR (0.48) CCKARCCKBR
SCHEMBL21755264 0.70 CCKBR (0.44) FPR2FPR1CCKARCCKBR

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
US-10881666-B2 Combination pharmaceutical agents as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2021-01-05 US disclosed
US-20190192535-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-06-27 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-10881666-B2 Combination pharmaceutical agents as RSV inhibitors SERPINB1, FURIN, HIF1AN FPR2 154/4885FPR1 72/4885ACHE 4676/4885
US-20190192535-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS SERPINB1, FURIN, HIF1AN FPR2 154/4885FPR1 72/4885ACHE 4676/4885

“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.