SCHEMBL79825

SCHEMBL79825

CC(C)(C)OC(=O)NC[C@H]1CCCN1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
DRD2 P14416 3/20 0.40
DRD3 P35462 2/20 0.40
SCN9A Q15858 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
GFER P55789 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
LMNA P02545 2/20 0.37
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CACNA1F O60840 1/20 0.37
KCNA5 P22460 1/20 0.37
SLC6A2 P23975 1/20 0.37
ADRA1A P35348 1/20 0.37
OPRK1 P41145 1/20 0.37

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
SCHEMBL1268688 1.00 EPHX1 (0.44) EPHX1DRD2DRD3SCN9AOPRM1
SCHEMBL145280 1.00 EPHX1 (0.44) EPHX1DRD2DRD3SCN9AOPRM1
Hydrochloric Acid SCHEMBL2417195 0.98 EPHX1 (0.43) EPHX1DRD2DRD3SCN9AOPRM1
Hydrochloric Acid SCHEMBL2422106 0.98 EPHX1 (0.43) EPHX1DRD2DRD3SCN9AOPRM1
SCHEMBL16528516 0.95 EPHX1 (0.47) EPHX1DRD2DRD3SCN9AOPRM1
SCHEMBL487705 0.95 EPHX1 (0.47) EPHX1DRD2DRD3SCN9AOPRM1
SCHEMBL1062309 0.95 EPHX1 (0.47) EPHX1DRD2DRD3SCN9AOPRM1
Formic Acid Methyl Ester SCHEMBL28112828 0.92 EPHX1 (0.39) EPHX1DRD2DRD3SCN9AOPRM1
SCHEMBL1398833 0.89 EPHX1 (0.44) EPHX1DRD2TDP1GFERTSHR
SCHEMBL18992238 0.89 EPHX1 (0.44) EPHX1DRD2TDP1GFERTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466815-B2 Carboxamide compounds and uses thereof INCYTE CORPORATION (US) 2025-11-11 US disclosed
EP-4619097-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2025-09-24 EP disclosed
WO-2025106477-A1 NOVEL AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2025-05-22 WO disclosed
CN-118619877-A Oxalyl diamine derivatives and uses thereof 中国科学院上海药物研究所 2024-09-10 CN disclosed
US-20240217989-A1 Heteroaryl Fluoroalkenes As DGK Inhibitors INCYTE CORPORATION 2024-07-04 US disclosed
WO-2024107434-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed
WO-2024108100-A1 HETEROARYL FLUOROALKENES AS DGK INHIBITORS INCYTE CORPORATION (US) 2024-05-23 WO disclosed
US-20240150326-A1 CARBOXAMIDE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2024-05-09 US disclosed
US-20230312479-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-10-05 US disclosed
US-11731958-B2 Carboxamide compounds and uses thereof INCYTE CORPORATION (US) 2023-08-22 US disclosed
WO-2005090344-A1 NOVEL DICHLORO-PHENYL-PYRIDO [2,3-D] PYRIMIDINE DERIVATES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-29 WO disclosed
EP-1575925-A1 NOVEL CARBOXAMIDES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2005-09-21 EP disclosed
WO-2004092171-A2 TRIAZOLO[1,5-A]PYRIMIDINES AND PYRAZOLO[1,5-A]PYRIMIDINES USEFUL AS A2A ADENOSIN E RECEPTOR ANTAGONISTS BIOGEN IDEC MA INC. (US) 2004-10-28 WO disclosed
WO-2004092170-A2 TRIAZOLOTRIAZINES AND PYRAZOLOTRIAZINES USEFUL AS A2A ADENOSINE RECEPTOR ANTAGON ISTS BIOGEN IDEC MA INC. (US) 2004-10-28 WO disclosed
WO-2004092172-A2 TRIAZOLO[1,5-C]PYRIMIDINES AND PYRAZOLO[1,5-C]PYRIMIDINES USEFUL AS A2A ADENOSIN E RECEPTOR ANTAGONISTS BIOGEN IDEC MA INC. (US) 2004-10-28 WO disclosed
US-20040176603-A1 Substituted nitrogen-containing heterobicycles, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-09-09 US disclosed
WO-2004056784-A1 NOVEL CARBOXAMIDES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-07-08 WO disclosed
EP-0871628-A1 QUINOLIZINONE TYPE COMPOUNDS Abbott Laboratories (US) 1998-10-21 EP disclosed
US-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 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 (6 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-20230312479-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP EPHX1 4836/4885DRD2 3574/4885DRD3 3412/4885
US-11731958-B2 Carboxamide compounds and uses thereof PCK1, PHKG2, PHKG1 EPHX1 1708/4885DRD2 4842/4885DRD3 4823/4885
US-20040176603-A1 Substituted nitrogen-containing heterobicycles, the preparation thereof and their use as pharmaceutical compositions F11, F12, F2 EPHX1 1415/4885DRD2 2845/4885DRD3 1754/4885
US-20240150326-A1 CARBOXAMIDE COMPOUNDS AND USES THEREOF PCK1, PHKG2, PHKG1 EPHX1 1708/4885DRD2 4842/4885DRD3 4823/4885
US-12466815-B2 Carboxamide compounds and uses thereof PCK1, PHKG2, PHKG1 EPHX1 1708/4885DRD2 4842/4885DRD3 4823/4885
US-20240217989-A1 Heteroaryl Fluoroalkenes As DGK Inhibitors DGKA, DGKG, DGKK EPHX1 1581/4885DRD2 2194/4885DRD3 2098/4885

“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.