SCHEMBL16708543

SCHEMBL16708543

CC[C@H]1O[C@@H](c2ccc3c(N)ncnn23)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.37
▸ PI4KA P42356 1/20 0.36
▸ PI4K2B Q8TCG2 1/20 0.36
▸ PI4K2A Q9BTU6 1/20 0.36
▸ PI4KB Q9UBF8 1/20 0.36
▸ MAP4K4 O95819 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ STING1 Q86WV6 1/20 0.32
▸ AMD1 P17707 2/20 0.31
▸ DOT1L Q8TEK3 1/20 0.31
▸ P2RX1 P51575 1/20 0.30
▸ P2RX3 P56373 1/20 0.30
▸ P2RX4 Q99571 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
SCHEMBL15605903 0.91 POLRMT (0.37) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL16710454 0.90 PI4KA (0.47) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL13532207 0.90 PI4KA (0.47) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL19344228 0.90 POLRMT (0.37) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL16708529 0.88 — —
SCHEMBL15605853 0.86 POLRMT (0.34) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL26807799 0.85 POLRMT (0.42) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL19779083 0.84 POLRMT (0.35) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL26829967 0.84 POLRMT (0.37) POLRMTPI4KAPI4K2BPI4K2API4KB
SCHEMBL24606260 0.83 POLRMT (0.37) POLRMTPI4KAPI4K2BPI4K2API4KB

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 POLRMT 306/4885PI4KA 3453/4885PI4K2B 2572/4885
US-20180016280-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 POLRMT 306/4885PI4KA 3453/4885PI4K2B 2572/4885
US-20150133395-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 POLRMT 306/4885PI4KA 3453/4885PI4K2B 2572/4885

“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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