SCHEMBL23148916

SCHEMBL23148916

Cc1ccc(S(=O)(=O)ON2CC(c3ccc4c(c3)CCC(C)(C)O4)C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.44
▸ PKLR P30613 1/20 0.42
▸ GHSR Q92847 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ PLCG2 P16885 1/20 0.40
▸ TRIM24 O15164 1/20 0.40
▸ BRD1 O95696 1/20 0.40
▸ BRPF1 P55201 1/20 0.40
▸ OPRM1 P35372 1/20 0.38
▸ DAGLA Q9Y4D2 8/20 0.37
▸ ABHD6 Q9BV23 2/20 0.36
▸ CYP2D6 P10635 3/20 0.36
▸ MLNR O43193 1/20 0.36
▸ CYP3A4 P08684 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ KDM1A O60341 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 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
SCHEMBL23148915 0.76 PKM (0.44) PKMPKLRGHSRMAPTPLCG2
SCHEMBL29616580 0.76 PKM (0.44) PKMPKLRGHSRMAPTPLCG2
SCHEMBL21381802 0.75 VDR (0.40) PKMMAPTCYP2D6CYP3A4CYP2C9
SCHEMBL21381827 0.75 VDR (0.33) PKMMAPTCYP2D6CYP3A4CYP2C9
SCHEMBL23149217 0.72 KDM1A (0.42) PKMPKLRGHSRMAPTTRIM24
SCHEMBL23091731 0.71 LMNA (0.49) MAPTCYP2D6CYP3A4CYP2C9CYP2C19
SCHEMBL21381682 0.71 PDE4B (0.40) MAPTCYP2D6ALDH1A1
SCHEMBL21381893 0.70 VDR (0.36) MAPTCYP2D6CYP3A4CYP2C9CYP2C19
SCHEMBL23148998 0.70 HRH3 (0.48) —
SCHEMBL21381636 0.70 KMT2A (0.36) CYP2D6CYP3A4CYP2C9CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4034538-A1 NEW HETEROCYCLIC MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. Hoffmann-La Roche AG (CH) 2022-08-03 — — EP disclosed
WO-2021058445-A1 NEW HETEROCYCLIC MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2021-04-01 — — WO disclosed
US-20210094973-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2021-04-01 — — 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 (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-20210094973-A1 HETEROCYCLIC COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP1A1, CYP1B1 PKM 722/4885PKLR 1884/4885GHSR 3030/4885

“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.

Send feedback