SCHEMBL20098548

SCHEMBL20098548

COC(=O)c1cc(Br)c(C2CC2)nc1N1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 14/20 0.52
▸ ALDH1A1 P00352 2/20 0.50
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ APAF1 O14727 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ TDP2 O95551 1/20 0.42
▸ NSD2 O96028 1/20 0.42
▸ PLA2G1B P04054 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ PLCG1 P19174 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ GALK1 P51570 1/20 0.42
▸ BLM P54132 1/20 0.42

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
SCHEMBL18412804 0.86 OPRK1 (0.45) OPRK1ALDH1A1
SCHEMBL18412806 0.86 OPRK1 (0.43) OPRK1ALDH1A1
SCHEMBL18412805 0.85 PKM (0.42) OPRK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL14251072 0.81 OPRK1 (0.41) OPRK1
SCHEMBL15901273 0.81 OPRK1 (0.41) OPRK1
SCHEMBL24612131 0.80 MTOR (0.37) OPRK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL20098539 0.76 SMN1; SMN2 (0.40) OPRK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL3719404 0.75 OPRK1 (0.75) OPRK1
SCHEMBL29574379 0.75 OPRK1 (0.75) OPRK1
SCHEMBL17996946 0.75 IDH1 (0.51) OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3324977-B1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2022-07-13 — — EP disclosed
US-10881666-B2 Combination pharmaceutical agents as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2021-01-05 — — US disclosed
US-10865215-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-12-15 — — US disclosed
US-20200223867-A1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2020-07-16 — — US disclosed
US-10570153-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-02-25 — — US disclosed
US-20190192535-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-06-27 — — US disclosed
WO-2019067864-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-04-04 — — WO disclosed
US-9957281-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2018-05-01 — — 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 (5 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-10865215-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 OPRK1 261/4885ALDH1A1 621/4885CYP1A2 58/4885
US-10881666-B2 Combination pharmaceutical agents as RSV inhibitors SERPINB1, FURIN, HIF1AN OPRK1 4619/4885ALDH1A1 3562/4885CYP1A2 4109/4885
US-10570153-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 OPRK1 261/4885ALDH1A1 621/4885CYP1A2 58/4885
US-20200223867-A1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS GABRA5, GABRA1, GABBR2 OPRK1 261/4885ALDH1A1 621/4885CYP1A2 58/4885
US-20190192535-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS SERPINB1, FURIN, HIF1AN OPRK1 4619/4885ALDH1A1 3562/4885CYP1A2 4109/4885

“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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