SCHEMBL21058751

SCHEMBL21058751

FC(F)(F)c1ccccc1-c1cc(Cl)nc(Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 2/20 0.47
CTSK P43235 1/20 0.44
TRPA1 O75762 2/20 0.43
TRPM8 Q7Z2W7 2/20 0.43
TRPV1 Q8NER1 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
HSD11B1 P28845 6/20 0.43
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
KMO O15229 2/20 0.42
BACE1 P56817 1/20 0.39
SCN9A Q15858 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL4291142 0.84 HSP90AA1 (0.64) ACP1CTSKHSP90AA1HSP90AB1BACE1
SCHEMBL802294 0.84 MEN1 (0.62) ACP1CTSKHSD11B1KMOSCN9A
SCHEMBL30514768 0.83 HSD11B1 (0.47) ACP1CTSKTRPA1TRPM8TRPV1
SCHEMBL20764969 0.83 HSD11B1 (0.47) ACP1CTSKTRPA1TRPM8TRPV1
SCHEMBL786418 0.80 HSP90AA1 (0.54) ACP1TRPA1TRPM8TRPV1CYP1A2
SCHEMBL786422 0.78 HSD11B1 (0.41) ACP1TRPA1TRPM8TRPV1CYP1A2
SCHEMBL20576367 0.77 NPC1 (0.47) CYP1A2HSP90AA1HSP90AB1MEN1ALDH1A1
SCHEMBL3327517 0.77 HSP90AA1 (0.68) HSP90AA1HSP90AB1MEN1ALDH1A1HPGD
SCHEMBL603189 0.77 CYP1A2 (0.61) CYP1A2CYP3A4HSD11B1KMOSCN9A
SCHEMBL3364843 0.77 KMO (0.60) ACP1TRPA1TRPM8TRPV1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190185456-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION, APPLICATION METHODS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-06-20 US disclosed
CN-107759571-A Inhibitors of influenza viruses replication and its application method and purposes 广东东阳光药业有限公司 2018-03-06 CN 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-20190185456-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION, APPLICATION METHODS AND USES THEREOF POLRMT, EIF2AK2, POLM ACP1 3081/4885CTSK 1233/4885TRPA1 4880/4885

“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.