SCHEMBL18050287

SCHEMBL18050287

CCSc1c(-c2nc3cc(C(F)(F)F)cnc3n2C)sc2cc(Br)ccc12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.43
▸ MAOB P27338 1/20 0.36
▸ ALDH1A1 P00352 7/20 0.33
▸ KDM4E B2RXH2 4/20 0.33
▸ HPGD P15428 4/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ GAA P10253 2/20 0.32
▸ PPARG P37231 3/20 0.32
▸ NCOA2 Q15596 3/20 0.32
▸ NCOA1 Q15788 3/20 0.32
▸ NCOA3 Q9Y6Q9 3/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ AKR1A1 P14550 1/20 0.31
▸ AKR1B1 P15121 1/20 0.31

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
SCHEMBL18072955 0.92 POLB (0.45) POLBMAOBALDH1A1KDM4EHPGD
SCHEMBL19299826 0.90 POLB (0.43) POLBALDH1A1KDM4EHPGDKMT2A
SCHEMBL18050235 0.88 POLB (0.32) POLB
SCHEMBL18050240 0.88 POLB (0.45) POLBALDH1A1KDM4EHPGDKMT2A
SCHEMBL19299802 0.86 POLB (0.43) POLBALDH1A1KDM4EHPGDKMT2A
SCHEMBL19711949 0.86 POLB (0.45) POLBMAOBALDH1A1KDM4EHPGD
SCHEMBL19283517 0.84 POLB (0.43) POLBALDH1A1KDM4EHPGDKMT2A
SCHEMBL18050266 0.84 POLB (0.40) POLBMAOBALDH1A1KDM4EHPGD
SCHEMBL24576480 0.82 POLB (0.43) POLBMAOBALDH1A1KMT2AMEN1
SCHEMBL19299824 0.80 POLB (0.43) POLBMAOBALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10494368-B2 Pesticidally active tetracyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2019-12-03 — — US disclosed
US-10494368-B2 Pesticidally active tetracyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2019-12-03 — — US disclosed
EP-3268361-B1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-09-18 — — EP disclosed
US-20190040060-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-02-07 — — US disclosed
US-20190040060-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-02-07 — — US disclosed
US-10131662-B2 Pesticidally active tetracyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2018-11-20 — — US disclosed
US-20180079748-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 — — US disclosed
US-20180079748-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 — — US disclosed
US-20180079748-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 — — US disclosed
EP-3268361-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Participations AG (CH) 2018-01-17 — — EP disclosed
WO-2016142327-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2016-09-15 — — 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 (4 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-20190040060-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, TST, ACHE POLB 3735/4885MAOB 791/4885ALDH1A1 892/4885
US-10494368-B2 Pesticidally active tetracyclic derivatives with sulfur containing substituents DDT, TST, ACHE POLB 3735/4885MAOB 791/4885ALDH1A1 892/4885
US-10131662-B2 Pesticidally active tetracyclic derivatives with sulfur containing substituents DDT, TST, ACHE POLB 3774/4885MAOB 631/4885ALDH1A1 1060/4885
US-20180079748-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, TST, ACHE POLB 3774/4885MAOB 631/4885ALDH1A1 1060/4885

“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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