SCHEMBL21474620

SCHEMBL21474620

C=CCN1CCc2cc(C(=O)c3ccccccccc3)sc2-c2ccc(F)cc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.41
NOTUM Q6P988 9/20 0.37
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 4/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 2/20 0.37
KDM4A O75164 1/20 0.36
KDM2B Q8NHM5 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM3 P20309 1/20 0.35
GAA P10253 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
PIK3CA P42336 1/20 0.34
MAPT P10636 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL21471717 1.00 MAPK14 (0.41) MAPK14NOTUMALDH1A1KDM4ELMNA
SCHEMBL20599068 0.89 NOTUM (0.46) NOTUMALDH1A1KDM4ELMNAHPGD
SCHEMBL21471714 0.87 CHRM2 (0.38) NOTUMALDH1A1KDM4ELMNAHPGD
SCHEMBL21471683 0.83 CHRM2 (0.36) NOTUMALDH1A1KDM4ELMNAHPGD
SCHEMBL21471675 0.83 ALDH1A1 (0.47) NOTUMALDH1A1KDM4ELMNAHPGD
SCHEMBL20622402 0.83 HPGD (0.42) ALDH1A1KDM4EHPGDCHRM2CHRM3
SCHEMBL21471787 0.83 CTSS (0.36) ALDH1A1KDM4ELMNAHPGDCHRM2
SCHEMBL21471614 0.82 KDM4E (0.36) NOTUMALDH1A1KDM4EHPGDCHRM2
SCHEMBL20619490 0.82 ALDH1A1 (0.50) MAPK14ALDH1A1KDM4ELMNAHPGD
SCHEMBL21471792 0.79 CHRM2 (0.36) KDM4AKDM2BKDM4CCHRM2CHRM3

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-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

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 MAPK14 2727/4885NOTUM 1555/4885ALDH1A1 701/4885
US-20190315766-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS SIRT1, FURIN, SIRT5 MAPK14 2727/4885NOTUM 1555/4885ALDH1A1 701/4885

“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.