SCHEMBL1811282

SCHEMBL1811282

COC(=O)c1ccc(C(F)(F)F)c(N)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.67
KDM4E B2RXH2 9/20 0.60
ALDH1A1 P00352 8/20 0.60
HPGD P15428 6/20 0.60
MAPT P10636 6/20 0.60
GAA P10253 3/20 0.60
HSD17B10 Q99714 3/20 0.60
GLA P06280 1/20 0.60
CASP1 P29466 1/20 0.60
CASP7 P55210 1/20 0.60
ATM Q13315 1/20 0.60
CFTR P13569 4/20 0.51
USP2 O75604 1/20 0.51
NPC1 O15118 3/20 0.49
NPSR1 Q6W5P4 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
ALOX15 P16050 1/20 0.48

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
SCHEMBL30665432 1.00 NOTUM (0.67) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL1712040 0.87 NOTUM (0.62) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL7608923 0.85 KDM4E (0.62) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL1997248 0.84 NOTUM (0.73) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL27490413 0.84 ALOX15 (0.48) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL1264358 0.83 LMNA (0.54) NOTUMKDM4EALDH1A1HPGDGAA
SCHEMBL19510005 0.82 KDM4E (0.58) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL3830811 0.81 NOTUM (0.69) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL3902096 0.81 NOTUM (0.69) NOTUMKDM4EALDH1A1HPGDMAPT
SCHEMBL3903076 0.81 NOTUM (0.69) NOTUMKDM4EALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
EP-3856178-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-03-11 EP disclosed
CN-117209469-A Compounds as CLK inhibitors and uses thereof 南京圣和药物研发有限公司 2023-12-12 CN disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
WO-2023207949-A1 FUSED RING COMPOUND AND USE THEREOF 中国科学院上海药物研究所 2023-11-02 WO disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
WO-2023011547-A1 CRYSTAL FORM OF COMPOUND INHIBITING FUNCTION OF ADAMTS-5 AND/OR ADAMTS-4, AND PREPARATION METHOD THEREFOR AND USE THEREOF 江苏恒瑞医药股份有限公司 2023-02-09 WO disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
WO-2022212638-A1 PRODRUGS OF ADAMTS INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2022-10-06 WO disclosed
EP-3122344-B1 TRKA KINASE INHIBITORS, COMPOSITIONS AND METHODS THEREOF MERCK SHARP & DOHME (US) 2022-04-27 EP disclosed
WO-2010124047-A1 BISARYL ALKYNYLAMIDES AS NEGATIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 5 (MGLUR5) WYETH LLC (US) 2010-10-28 WO disclosed
WO-2010124047-A1 BISARYL ALKYNYLAMIDES AS NEGATIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 5 (MGLUR5) WYETH LLC (US) 2010-10-28 WO disclosed
US-20100273772-A1 Bisaryl Alkynylamides as Negative Allosteric Modulators of Metabotropic Glutamate Receptor 5 (MGLUR5) WYETH LLC (US) 2010-10-28 US disclosed
US-20100022467-A1 ANTI-CANCER PHOSPHONATE ANALOGS BOOJAMRA CONSTANTINE G 2010-01-28 US disclosed
US-20090325964-A1 Piperazine Metabotropic Glutamate Receptor 5 (MGLUR5) Negative Allosteric Modulators For Anxiety/Depression WYETH (US) 2009-12-31 US disclosed
WO-2009143404-A1 PIPERAZINE METABOTROPIC GLUTAMATE RECEPTOR 5 (MGLUR5) NEGATIVE ALLOSTERIC MODULATORS FOR ANXIETY/DEPRESSION WYETH (US) 2009-11-26 WO disclosed
US-20090227543-A1 PHOSPHONATE COMPOUNDS HAVING IMMUNO-MODULATORY ACTIVITY CANNIZZARO CARINA 2009-09-10 US disclosed
US-20090227543-A1 PHOSPHONATE COMPOUNDS HAVING IMMUNO-MODULATORY ACTIVITY CANNIZZARO CARINA 2009-09-10 US disclosed
US-7470724-B2 Phosphonate compounds having immuno-modulatory activity GILEAD SCIENCES, INC. (US) 2008-12-30 US disclosed
US-7452901-B2 Anti-cancer phosphonate analogs GILEAD SCIENCES, INC. (US) 2008-11-18 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 (8 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP NOTUM 931/4885KDM4E 2437/4885ALDH1A1 312/4885
US-20090325964-A1 Piperazine Metabotropic Glutamate Receptor 5 (MGLUR5) Negative Allosteric Modulators For Anxiety/Depression GRM5, GRIK5, GRM1 NOTUM 4168/4885KDM4E 1411/4885ALDH1A1 3104/4885
US-20090227543-A1 PHOSPHONATE COMPOUNDS HAVING IMMUNO-MODULATORY ACTIVITY PHOSPHO1, NFATC1, IFNG NOTUM 2093/4885KDM4E 3404/4885ALDH1A1 4028/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH NOTUM 1059/4885KDM4E 3565/4885ALDH1A1 587/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP NOTUM 931/4885KDM4E 2437/4885ALDH1A1 312/4885
US-20100273772-A1 Bisaryl Alkynylamides as Negative Allosteric Modulators of Metabotropic Glutamate Receptor 5 (MGLUR5) GRM5, GRM1, GRM2 NOTUM 2929/4885KDM4E 761/4885ALDH1A1 1776/4885
US-20100022467-A1 ANTI-CANCER PHOSPHONATE ANALOGS PIK3CA, PHOSPHO1, PTEN NOTUM 4122/4885KDM4E 1893/4885ALDH1A1 3678/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP NOTUM 931/4885KDM4E 2437/4885ALDH1A1 312/4885

“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.