SCHEMBL25297736

SCHEMBL25297736

CS(=O)(=O)c1ccc(CN2CCC3(CC2)CN(C(=O)CC[C@@H]2COC(=O)N2)C3)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.38
▸ GPR183 P32249 2/20 0.37
▸ KDM1A O60341 2/20 0.36
▸ MAOB P27338 2/20 0.36
▸ CYP2D6 P10635 6/20 0.36
▸ CYP3A4 P08684 4/20 0.36
▸ TSHR P16473 3/20 0.36
▸ CCR5 P51681 2/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ GPR119 Q8TDV5 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ RCOR1 Q9UKL0 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 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
SCHEMBL25301321 0.90 DRD2 (0.38) LMNACYP2D6CYP3A4TSHRMEN1
SCHEMBL29497103 0.90 DRD2 (0.38) LMNACYP2D6CYP3A4TSHRMEN1
SCHEMBL25295986 0.89 TEAD1 (0.38) GPR183CYP2D6CYP3A4TSHRCYP1A2
SCHEMBL25255790 0.84 CCR5 (0.35) CCR5GPR119MEN1KMT2A
SCHEMBL29497053 0.83 MGLL (0.41) GPR183CYP2D6CYP3A4TSHRKCNH2
SCHEMBL25292205 0.83 MGLL (0.41) GPR183CYP2D6CYP3A4TSHRKCNH2
SCHEMBL25298279 0.81 USP2 (0.37) LMNAGPR183CYP2D6CYP3A4TSHR
SCHEMBL25258066 0.80 TEAD1 (0.35) LMNACYP2D6CYP3A4TSHRMEN1
SCHEMBL25256643 0.76 ENPP2 (0.36) MEN1KMT2A
SCHEMBL29496991 0.76 ENPP2 (0.36) MEN1KMT2A

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
US-11981661-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-05-14 — — US claimed
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 — — EP claimed
CN-115989228-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-04-18 — — CN claimed
US-20220098176-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-03-31 — — US claimed
US-11981661-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-05-14 — — US disclosed
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 — — EP disclosed
CN-115989228-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-04-18 — — CN disclosed
US-20220098176-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-03-31 — — 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 (2 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-20220098176-A1 HETEROCYCLIC COMPOUNDS CBR3, BRIX1, CCNY LMNA 154/4885GPR183 1629/4885KDM1A 1612/4885
US-11981661-B2 Heterocyclic compounds CBR3, BRIX1, CCNY LMNA 154/4885GPR183 1629/4885KDM1A 1612/4885

“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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