SCHEMBL2661809

SCHEMBL2661809

CCCN1Cc2nc3c(-c4ccccc4C(F)(F)F)cccc3c(N)c2C1=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.37
▸ HSD11B1 P28845 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ PARP2 Q9UGN5 1/20 0.36
▸ P2RX7 Q99572 1/20 0.35
▸ TRPA1 O75762 1/20 0.34
▸ CBLB Q13191 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ PTPN1 P18031 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2D6 P10635 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ C1R P00736 1/20 0.33
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL2660324 0.88 MAPT (0.37) ALDH1A1
SCHEMBL2660780 0.86 GABRG2 (0.42) TLR8LMNAPARP1HTTPARP2
SCHEMBL2660012 0.85 LMNA (0.38) TLR8LMNAPARP1HTTPARP2
SCHEMBL2660713 0.85 HRH4 (0.42) LMNAPARP1HTTPARP2ALDH1A1
SCHEMBL2659737 0.84 PDE5A (0.34) TLR8LMNAPARP1HTTPARP2
SCHEMBL2658433 0.84 LMNA (0.38) TLR8LMNAPARP1HTTPARP2
SCHEMBL2655382 0.83 LMNA (0.38) TLR8LMNAPARP1HTTPARP2
SCHEMBL2661594 0.83 USP1 (0.40) LMNAHTT
SCHEMBL2658389 0.82 GRM1 (0.38) LMNAPARP1HTTPARP2ALDH1A1
SCHEMBL4921028 0.82 LMNA (0.36) LMNAPARP1HTTPARP2ALDH1A1

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-2176263-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS AstraZeneca AB (SE) 2010-04-21 — — EP claimed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US claimed
WO-2008155572-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS ASTRAZENECA AB (SE) 2008-12-24 — — WO claimed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — 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-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF TLR8 233/4885HSD11B1 431/4885LMNA 1909/4885

“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.

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