SCHEMBL21458042

SCHEMBL21458042

C=CCN1CCc2cc(CO)sc2-c2ccc(F)cc21

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.35
CHRM3 P20309 1/20 0.35
KDM4A O75164 1/20 0.30
KDM2B Q8NHM5 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
PER2 O15055 1/20 0.30
CRY2 Q49AN0 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
SCHEMBL21471792 0.83 CHRM2 (0.36) CHRM2CHRM3KDM4AKDM2BKDM4C
SCHEMBL21471714 0.83 CHRM2 (0.38) CHRM2CHRM3KDM4AKDM2BKDM4C
SCHEMBL20599068 0.83 NOTUM (0.46) CHRM2CHRM3KDM4AKDM2BKDM4C
SCHEMBL21471683 0.79 CHRM2 (0.36) CHRM2CHRM3KDM4AKDM2BKDM4C
SCHEMBL21471675 0.79 ALDH1A1 (0.47) CHRM2CHRM3
SCHEMBL21474620 0.79 MAPK14 (0.41) CHRM2CHRM3KDM4AKDM2BKDM4C
SCHEMBL21471717 0.79 MAPK14 (0.41) CHRM2CHRM3KDM4AKDM2BKDM4C
SCHEMBL21471614 0.78 KDM4E (0.36) CHRM2CHRM3
SCHEMBL20619490 0.78 ALDH1A1 (0.50) CHRM2CHRM3
SCHEMBL21478313 0.77 CHRM2 (0.36) CHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10975094-B2 Heterocyclic compounds as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2021-04-13 US disclosed
US-10975094-B2 Heterocyclic compounds as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2021-04-13 US disclosed
US-20190315766-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-10-17 US disclosed
US-20190315766-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-10-17 US disclosed
WO-2019199908-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-10-17 WO disclosed
WO-2019199908-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-10-17 WO 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-10975094-B2 Heterocyclic compounds as RSV inhibitors SIRT1, FURIN, SIRT5 CHRM2 3915/4885CHRM3 2654/4885KDM4A 962/4885
US-20190315766-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS SIRT1, FURIN, SIRT5 CHRM2 3915/4885CHRM3 2654/4885KDM4A 962/4885

“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.