SCHEMBL6480320

SCHEMBL6480320

Fc1ccccc1-c1nc(Nc2c(F)cccc2F)c2ncn(Cc3ccccc3)c2n1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.57
▸ ADORA2A P29274 3/20 0.55
▸ YTHDC1 Q96MU7 5/20 0.48
▸ CDK1 P06493 1/20 0.48
▸ ADORA3 P0DMS8 1/20 0.48
▸ CTSL P07711 3/20 0.47
▸ PDE4A P27815 2/20 0.46
▸ PDE4B Q07343 2/20 0.46
▸ PDE4C Q08493 2/20 0.46
▸ PDE4D Q08499 2/20 0.46
▸ PDE8A O60658 1/20 0.43
▸ CTSB P07858 1/20 0.42
▸ HTT P42858 1/20 0.42

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
SCHEMBL6482227 0.82 MAPK14 (0.60) MAPK14ADORA2ACDK1PDE4APDE4B
SCHEMBL6249030 0.81 MAPK14 (0.53) MAPK14ADORA2AADORA3
SCHEMBL6247857 0.80 TLR9 (0.57) MAPK14ADORA2A
SCHEMBL6493063 0.79 MAPK14 (0.39) MAPK14ADORA2ACDK1PDE4APDE4B
SCHEMBL6249806 0.75 MAPK14 (0.56) MAPK14YTHDC1CDK1
SCHEMBL6484946 0.73 MAPK14 (0.56) MAPK14
SCHEMBL6482024 0.73 MAPK14 (1.00) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL6252502 0.71 MAPK14 (0.53) MAPK14ADORA2ACDK1ADORA3PDE4A
SCHEMBL6247904 0.70 MAPK14 (0.56) MAPK14
SCHEMBL7536448 0.69 YTHDC1 (0.74) ADORA2AYTHDC1CDK1

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-20050288503-A1 Novel compounds ADAMS JERRY L 2005-12-29 — — 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-20050288503-A1 Novel compounds CREBBP, NCBP1, MAPKAPK2 MAPK14 48/4885ADORA2A 4021/4885YTHDC1 4038/4885

“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.

Send feedback