SCHEMBL16708478

SCHEMBL16708478

C[C@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](c2ccc3c(NC(=O)c4ccccc4)ncnn23)O[C@@H]1CO

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.39
▸ POLB P06746 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ ADORA3 P0DMS8 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ ABL1 P00519 1/20 0.30
▸ RIN1 Q13671 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL16708476 0.93 SMN1; SMN2 (0.35) TMPRSS2TDP1ADORA3NPC1RAB9A
SCHEMBL16708474 0.93 TMPRSS2 (0.34) TMPRSS2TDP1NPC1RAB9ACYP1A2
SCHEMBL19101768 0.92 TMPRSS2 (0.42) TMPRSS2POLBTDP1ADORA3
SCHEMBL19101885 0.86 TMPRSS2 (0.37) TMPRSS2TDP1NPC1RAB9A
SCHEMBL16708480 0.84 TMPRSS2 (0.43) TMPRSS2POLBTDP1ADORA3NPC1
SCHEMBL16708475 0.82 TMPRSS2 (0.39) TMPRSS2TDP1NPC1RAB9A
SCHEMBL18371670 0.82 TMPRSS2 (0.39) TMPRSS2TDP1NPC1RAB9A
SCHEMBL19768734 0.82 TMPRSS2 (0.39) TMPRSS2TDP1NPC1RAB9A
SCHEMBL16708479 0.82 TDP1 (0.35) TMPRSS2TDP1NPC1RAB9ASMN1; SMN2
SCHEMBL19101754 0.81 TMPRSS2 (0.40) TMPRSS2POLBTDP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180016280-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. 2018-01-18 — — US disclosed
US-9701682-B2 Pyrrolo[1,2-f][1,2,4]triazines useful for treating respiratory syncitial virus infections GILEAD SCIENCES, INC. (US) 2017-07-11 — — US disclosed
US-20170008897-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. 2017-01-12 — — US disclosed
US-9388208-B2 Pyrrolo[1,2-f][1,2,4]triazines useful for treating respiratory syncitial virus infections GILEAD SCIENCES, INC. (US) 2016-07-12 — — US disclosed
US-20150133395-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS ROSEMOUNT INC. 2015-05-14 — — 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 (3 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-20170008897-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 TMPRSS2 20/4885POLB 1269/4885TDP1 624/4885
US-20180016280-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 TMPRSS2 20/4885POLB 1269/4885TDP1 624/4885
US-20150133395-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 TMPRSS2 20/4885POLB 1269/4885TDP1 624/4885

“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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