SCHEMBL21755133

SCHEMBL21755133

O=C1Nc2ccccc2C(c2ccccc2)=N[C@@H]1Nc1nnc(-c2ccc(N3CCOCC3)nc2)o1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CBLB Q13191 14/20 0.47
ATR Q13535 1/20 0.46
BRD4 O60885 1/20 0.43
CREBBP Q92793 1/20 0.43
CCKAR P32238 4/20 0.42
CCKBR P32239 3/20 0.42
CNR2 P34972 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
SCHEMBL20098079 1.00 CBLB (0.47) CBLBATRBRD4CREBBPCCKAR
SCHEMBL24611934 0.90 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20098488 0.90 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20098419 0.90 CBLB (0.47) CBLBATRCCKARCCKBR
SCHEMBL24611915 0.90 CBLB (0.47) CBLBATRCCKARCCKBR
SCHEMBL20098381 0.89 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20098095 0.89 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20098098 0.89 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20098341 0.88 CBLB (0.45) CBLBCCKARCCKBR
SCHEMBL20098168 0.86 CBLB (0.51) CBLBCCKARCCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10570153-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-02-25 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-10570153-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 CBLB 2850/4885ATR 3141/4885BRD4 798/4885

“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.