SCHEMBL363418

SCHEMBL363418

Oc1ccc(Cl)c(OC(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.46
NOTUM Q6P988 2/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
PDE3A Q14432 1/20 0.40
EPHX1 P07099 1/20 0.39
KDM4A O75164 2/20 0.38
KDM5A P29375 2/20 0.38
GRIN2B Q13224 1/20 0.38
PGK1 P00558 1/20 0.37
TTR P02766 2/20 0.36
MAOB P27338 1/20 0.36
CAMK2A Q9UQM7 1/20 0.36
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
KMO O15229 2/20 0.35

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
SCHEMBL22815923 0.85 NOTUM (0.49) NOTUMPDE3AAKR1C2AKR1C1KMO
SCHEMBL30026351 0.84 HSD17B10 (0.46) HSD17B10GRIN2BTTRKMO
SCHEMBL365685 0.84 HSD17B10 (0.46) HSD17B10GRIN2BTTRKMO
SCHEMBL3026638 0.81 EPHX2 (0.41) MAOB
SCHEMBL8778326 0.79 MAOB (0.54) HSD17B10MAOB
SCHEMBL22815981 0.78 RHEB (0.49) GRIN2BAKR1C2AKR1C1
SCHEMBL4055218 0.78 EPHX2 (0.42) HSD17B10CA12CA2CA9CA14
SCHEMBL29890447 0.78 EPHX2 (0.42) HSD17B10CA12CA2CA9CA14
SCHEMBL8462016 0.78 NOTUM (0.44) NOTUMPDE3AEPHX1GRIN2BPGK1
SCHEMBL25798505 0.77 PDE2A (0.40) HSD17B10MAOB

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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12577257-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2026-03-17 US disclosed
US-12240855-B2 Pyrrolopyrazole derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-03-04 US disclosed
EP-3968994-B1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME H LUNDBECK AS (DK) 2023-12-27 EP disclosed
US-11851428-B2 Activator of TREK (TWIK RElated K+channels) channels ONO PHARMACEUTICAL CO., LTD. (JP) 2023-12-26 US disclosed
EP-3883936-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2023-07-12 EP disclosed
US-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease BIOMARIN PHARMACEUTICAL INC. (US) 2022-07-12 US disclosed
US-20220213074-A1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2022-07-07 US disclosed
US-20220213074-A1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2022-07-07 US disclosed
US-20220185815-A1 PYRROLOPYRAZOLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-06-16 US disclosed
CN-113939290-A ABHD12 inhibitors and methods of making and using the same H.隆德贝克有限公司 2022-01-14 CN disclosed
CN-1738794-B Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY 2010-12-22 CN disclosed
EP-1565430-B1 BIGUANIDE DERIVATIVES JACOBUS PHARMA CO INC (US) 2010-02-17 EP disclosed
US-7563792-B2 Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY, INC. (US) 2009-07-21 US disclosed
US-20080176852-A1 BIGUANIDE AND DIHYDROTRIAZINE DERIVATIVES JACOBUS PHARMACEUTICAL COMPANY, INC. 2008-07-24 US disclosed
US-7256218-B2 Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY, INC. (US) 2007-08-14 US disclosed
CN-1738794-A Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY (US) 2006-02-22 CN disclosed
EP-1565430-A1 BIGUANIDE AND DIHYDROTRIAZINE DERIVATIVES JACOBUS PHARMACEUTICAL CO. INC. (US) 2005-08-24 EP disclosed
WO-2005037839-A1 NORCANTHARIDIN DERIVATIVE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF ENTOMED (FR) 2005-04-28 WO disclosed
US-20040116428-A1 Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY, INC. 2004-06-17 US disclosed
WO-2004048320-A1 BIGUANIDE AND DIHYDROTRIAZINE DERIVATIVES JACOBUS PHARMACEUTICAL COMPANY, INC. (US) 2004-06-10 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 (7 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-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease XDH, PNPO, AGXT HSD17B10 296/4885NOTUM 643/4885CA12 1470/4885
US-11851428-B2 Activator of TREK (TWIK RElated K+channels) channels KCNJ11, KCNJ1, KCNJ8 HSD17B10 3294/4885NOTUM 3726/4885CA12 4793/4885
US-20080176852-A1 BIGUANIDE AND DIHYDROTRIAZINE DERIVATIVES QDPR, DHODH, GLMN HSD17B10 2509/4885NOTUM 2570/4885CA12 2273/4885
US-20220185815-A1 PYRROLOPYRAZOLE DERIVATIVE PTDSS1, PTDSS2, SMPD1 HSD17B10 1478/4885NOTUM 1437/4885CA12 4349/4885
US-12240855-B2 Pyrrolopyrazole derivative PTDSS1, PTDSS2, SMPD1 HSD17B10 1478/4885NOTUM 1437/4885CA12 4349/4885
US-20220213074-A1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME ABHD12, SAMHD1, ABHD11 HSD17B10 814/4885NOTUM 2628/4885CA12 3764/4885
US-12577257-B2 Heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, CBR3 HSD17B10 1297/4885NOTUM 3019/4885CA12 778/4885

“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.