SCHEMBL21117152

SCHEMBL21117152

Cc1noc(C)c1-c1cc(C#N)ccc1-c1nnc(NC2N=C(c3ccccc3)C3=CCCC=C3NC2=O)o1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.34
BRD4 O60885 8/20 0.33
CREBBP Q92793 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 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
SCHEMBL20098240 0.86 CCKBR (0.48) CCKBRBRD4
SCHEMBL21117299 0.75 FPR2 (0.37) CCKBR
SCHEMBL21117574 0.73 FPR2 (0.39)
SCHEMBL21117290 0.73 FPR2 (0.38) CCKBR
SCHEMBL21117554 0.69 TUBB4A (0.35) CCKBR
SCHEMBL20098588 0.69 CCKBR (0.51) CCKBR
SCHEMBL20098242 0.69 CCKBR (0.50) CCKBR
SCHEMBL20098632 0.69 CCKBR (0.48) CCKBR
SCHEMBL21117371 0.68 CBLB (0.33)
SCHEMBL21755215 0.68 CCKBR (0.55) CCKBR

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 CCKBR 3869/4885BRD4 698/4885CREBBP 1711/4885
US-20190192535-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS SERPINB1, FURIN, HIF1AN CCKBR 3869/4885BRD4 698/4885CREBBP 1711/4885

“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.