SCHEMBL16809746

SCHEMBL16809746

FC1CN(Cc2cc3c(Cl)nccc3[nH]2)C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.34
▸ METTL14 Q9HCE5 1/20 0.34
▸ CYP19A1 P11511 1/20 0.33
▸ DRD4 P21917 5/20 0.32
▸ SIGMAR1 Q99720 4/20 0.32
▸ DRD3 P35462 3/20 0.32
▸ CD274 Q9NZQ7 3/20 0.32
▸ PDCD1 Q15116 2/20 0.32
▸ DRD5 P21918 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ ADRA2A P08913 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ ADRA2B P18089 1/20 0.32
▸ ADRA2C P18825 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ F10 P00742 1/20 0.31
▸ CCR8 P51685 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ PDCD1LG2 Q9BQ51 1/20 0.31
▸ CCNK O75909 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
SCHEMBL16794962 0.88 DRD4 (0.40) METTL3METTL14CYP19A1DRD4SIGMAR1
SCHEMBL16809739 0.82 ALDH1A1 (0.40) DRD4DRD3HTR1AADRA2ADRD2
SCHEMBL16809638 0.81 METAP2 (0.41) —
SCHEMBL16809738 0.80 CHEK1 (0.39) CYP19A1DRD4SIGMAR1DRD3DRD5
SCHEMBL16794956 0.79 CCNK (0.47) CCNKCDK12
SCHEMBL16809645 0.78 CLK2 (0.40) DRD4SIGMAR1DRD3DYRK1ADRD1
SCHEMBL16809745 0.76 ICAM1 (0.35) METTL3METTL14CYP19A1DRD4SIGMAR1
SCHEMBL16809569 0.74 DYRK1A (0.35) MAPK1DYRK1A
SCHEMBL16795087 0.72 NUDT1 (0.46) CCNKCDK12
SCHEMBL22641204 0.72 PDE3B (0.41) DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9643967-B2 Pyrrolo[3,2-c]pyridine derivatives as TLR inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-05-09 — — US disclosed
US-20170008885-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AS TLR INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-01-12 — — US disclosed
WO-2015088045-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AS TLR INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-06-18 — — 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 (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-20170008885-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AS TLR INHIBITORS TLR9, TLR7, TLR1 METTL3 3091/4885METTL14 4147/4885CYP19A1 3944/4885

“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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