SCHEMBL23434906

SCHEMBL23434906

CC(C)Cc1cc(Cl)cc2cccnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 4/20 0.42
▸ CCR8 P51685 4/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ SLC40A1 Q9NP59 1/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ CASP6 P55212 1/20 0.39
▸ HSP90AA1 P07900 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ HTT P42858 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ CCR5 P51681 2/20 0.38
▸ PSMD14 O00487 2/20 0.38
▸ COPS5 Q92905 2/20 0.38
▸ PDE4A P27815 1/20 0.38

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
SCHEMBL23434905 0.83 CCR1 (0.40) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL23434806 0.82 CCR1 (0.33) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL2606635 0.82 SLC40A1 (0.47) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL10880120 0.82 CCR1 (0.46) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL12404704 0.79 CCR1 (0.46) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL29491307 0.79 CCR1 (0.50) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL24338471 0.79 CCR1 (0.50) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL585843 0.78 PSMD14 (0.50) CCR1CCR8L3MBTL1ALDH1A1MEN1
SCHEMBL17926739 0.76 CCR1 (0.36) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL23979291 0.76 CCR1 (0.56) CCR1CCR8L3MBTL1ALDH1A1HSP90AA1

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-20210163454-A1 SMALL MOLECULE INHIBITORS OF EBOLA AND LASSA FEVER VIRUSES AND METHODS OF USE THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2021-06-03 — — 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-20210163454-A1 SMALL MOLECULE INHIBITORS OF EBOLA AND LASSA FEVER VIRUSES AND METHODS OF USE CCR8, RPS8, HDHD5 CCR1 13/4885CCR8 1/4885L3MBTL1 44/4885

“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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