SCHEMBL17194371

SCHEMBL17194371

CC(C)(C)OC(=O)N1CCc2c(sc(-c3ccccc3)c2C#N)C1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ GAA P10253 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ ADORA1 P30542 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.48
▸ P2RX3 P56373 4/20 0.47
▸ GRM1 Q13255 2/20 0.45
▸ BPTF Q12830 1/20 0.45
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ MKNK1 Q9BUB5 3/20 0.43

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
SCHEMBL17194353 0.82 ADORA1 (0.50) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL3421633 0.81 ALDH1A1 (0.62) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL17194372 0.81 ADORA1 (0.54) MAPTADORA1KDM4EP2RX3MKNK1
SCHEMBL17194176 0.80 ADORA1 (0.55) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL17194311 0.80 ADORA1 (0.55) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL20922384 0.80 ADORA1 (0.55) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL2643671 0.80 MAPT (0.73) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL2643572 0.79 MEN1 (0.56) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL2643570 0.79 MEN1 (0.53) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL2644838 0.78 MEN1 (0.55) MAPTMEN1KMT2AGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3131890-B1 COMPOUNDS FOR TREATING VIRAL INFECTIONS PASTEUR INSTITUT KOREA (KR) 2019-04-24 — — EP disclosed
US-9809602-B2 Compounds for treating viral infections INSTITUT PASTEUR KOREA (KR) 2017-11-07 — — US disclosed
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2017-02-16 — — US disclosed
WO-2015158908-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2015-10-22 — — 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-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, EIF2AK2 MAPT 2197/4885MEN1 4484/4885KMT2A 3994/4885

“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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