SCHEMBL18557964

SCHEMBL18557964

Cc1cc2c([nH]1)c(=O)[nH]c(=S)n2CCOC(C)C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 8/20 0.66
▸ OPRM1 P35372 1/20 0.66
▸ TSHR P16473 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RAB9A P51151 1/20 0.35
▸ PLK1 P53350 1/20 0.34

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
SCHEMBL28896602 0.86 MPO (0.65) MPOOPRM1TSHRALDH1A1CYP1A2
Verdiperstat SCHEMBL1536607 0.80 MPO (1.00) MPOOPRM1TPOCYP3A4KCNH2
SCHEMBL28896358 0.76 MPO (0.61) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL28896613 0.73 MPO (0.61) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL1776521 0.73 MPO (0.61) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL28896664 0.73 MPO (0.58) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL28959839 0.72 MPO (0.60) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL27101979 0.72 MPO (0.57) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL28896658 0.72 MPO (0.57) MPOOPRM1TSHRALDH1A1CYP1A2
SCHEMBL23225719 0.72 MPO (0.56) MPOOPRM1TSHRALDH1A1CYP1A2

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
US-11738027-B2 MPO inhibitors for use in medicine ASTRAZENECA AB (SE) 2023-08-29 — — US disclosed
US-20220160715-A1 MPO INHIBITORS FOR USE IN MEDICINE ASTRAZENECA AB (SE) 2022-05-26 — — US disclosed
US-11246870-B2 MPO inhibitors for use in medicine ASTRAZENCA AB (SE) 2022-02-15 — — US disclosed
US-9580429-B2 Pyrrolo[3,2-D]pyrimidin-4-one derivatives and their use in therapy ASTRAZENECA AB (SE) 2017-02-28 — — 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-11738027-B2 MPO inhibitors for use in medicine MPO, SERPINB1, MMP8 MPO 1/4885OPRM1 396/4885TSHR 1888/4885
US-11246870-B2 MPO inhibitors for use in medicine MPO, SERPINB1, MMP8 MPO 1/4885OPRM1 396/4885TSHR 1888/4885
US-20220160715-A1 MPO INHIBITORS FOR USE IN MEDICINE MPO, SERPINB1, MMP8 MPO 1/4885OPRM1 396/4885TSHR 1888/4885

“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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