SCHEMBL6208052

SCHEMBL6208052

CCc1ccc(Nc2c(-c3nnc(N4CCC(N5CCCC5)CC4)o3)ccc(F)c2F)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.34
TACR1 P25103 1/20 0.34
CCR4 P51679 2/20 0.33
ACKR3 P25106 1/20 0.33
KCNH2 Q12809 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
VCP P55072 1/20 0.31
GALR1 P47211 1/20 0.31
L3MBTL3 Q96JM7 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CYP3A4 P08684 1/20 0.30
KDR P35968 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
SCHEMBL6207211 0.92 BCHE (0.37) BCHEACHEBACE1VCP
SCHEMBL6206922 0.86 BCHE (0.37) KCNH2BCHEACHEBACE1CYP3A4
SCHEMBL6230497 0.85 KCNH2 (0.38) KCNH2BCHEACHEBACE1CYP3A4
SCHEMBL6404616 0.85 BCHE (0.37) BCHEACHEBACE1
SCHEMBL6206805 0.83 BCHE (0.39) BCHEACHEBACE1
SCHEMBL6207402 0.83 AVPR1A (0.33) BCHEACHEBACE1VCPKDR
SCHEMBL6208348 0.81 EEF2K (0.37) KCNH2BCHEACHEBACE1CYP3A4
SCHEMBL6205424 0.81 ACHE (0.56) BCHEACHEBACE1
SCHEMBL6207041 0.80 KDM4E (0.47) CYP3A4
SCHEMBL6207452 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578736-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL-PHENYLAMINE DERIVATIVES Warner-Lambert Company LLC (US) 2005-09-28 EP claimed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 US claimed
WO-2004056789-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL PHENYLAMINE DERIVATES WARNER-LAMBERT COMPANY LLC (US) 2004-07-08 WO claimed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 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-20050004186-A1 MEK inhibiting compounds MAPK1, MAP3K1, MAPK3 HRH3 1029/4885TACR1 3718/4885CCR4 827/4885

“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.