SCHEMBL23717329

SCHEMBL23717329

Cn1cc2cc(C(=O)NCC(O)(c3cc4c(c(-c5ccc(F)cc5)n3)OC[C@@]4(N)C(F)(F)F)C3CC3)cc(F)c2n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 3/20 0.33
HSD17B13 Q7Z5P4 1/20 0.32
CFTR P13569 3/20 0.31
CSNK1D P48730 3/20 0.31
CSNK1E P49674 3/20 0.31
CYP2C9 P11712 1/20 0.30
MAPK14 Q16539 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
SCHEMBL23717569 1.00 GABRA5 (0.33) GABRA5HSD17B13CFTRCSNK1DCSNK1E
SCHEMBL23700479 0.92 GABRA5 (0.33) GABRA5CFTRCSNK1DCSNK1E
SCHEMBL23700477 0.92 GABRA5 (0.33) GABRA5CFTRCSNK1DCSNK1E
SCHEMBL23700478 0.92 GABRA5 (0.33) GABRA5CFTRCSNK1DCSNK1E
SCHEMBL23717353 0.92 GABRA5 (0.32) GABRA5
SCHEMBL23717354 0.92 GABRA5 (0.32) GABRA5
SCHEMBL23700474 0.91 GPR6 (0.32) GABRA5
SCHEMBL23700476 0.91 GPR6 (0.32) GABRA5
SCHEMBL23717091 0.91 NAMPT (0.36)
SCHEMBL23717393 0.91 NAMPT (0.36)

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-11420976-B2 Heterocyclic compounds as anti-viral agents ENANTA PHARMACEUTICALS, INC. (US) 2022-08-23 US disclosed
US-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2021-08-05 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-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN GABRA5 3187/4885HSD17B13 647/4885CFTR 307/4885
US-11420976-B2 Heterocyclic compounds as anti-viral agents VIP, ACE, FURIN GABRA5 3187/4885HSD17B13 647/4885CFTR 307/4885

“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.