SCHEMBL741730

SCHEMBL741730

CC(C)(C)OC(=O)N1Cc2nc(Br)sc2C1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.42
GRAMD1A Q96CP6 1/20 0.41
MKNK1 Q9BUB5 3/20 0.39
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
HDAC1 Q13547 1/20 0.36
P2RX3 P56373 1/20 0.35
EPHX2 P34913 1/20 0.35
NR1H2 P55055 1/20 0.35
STS P08842 1/20 0.35
ESR2 Q92731 1/20 0.35
PARP1 P09874 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PARP2 Q9UGN5 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
SCHEMBL165650 0.87 GRAMD1A (0.53) ADORA1GRAMD1AMKNK1MAPTKDM4E
SCHEMBL19549675 0.87 ADORA1 (0.48) ADORA1GRAMD1AMKNK1USP2SMN1; SMN2
SCHEMBL31409413 0.85 GRAMD1A (0.47) ADORA1GRAMD1AMKNK1MAPTKDM4E
SCHEMBL741852 0.84 ADORA1 (0.47) ADORA1GRAMD1AUSP2SMN1; SMN2MAPT
SCHEMBL12035965 0.83 ADORA1 (0.46) ADORA1GRAMD1AMKNK1USP2SMN1; SMN2
SCHEMBL26094092 0.82 ADORA1 (0.40) ADORA1GRAMD1AUSP2SMN1; SMN2MAPT
SCHEMBL1504298 0.82 ADORA1 (0.45) ADORA1GRAMD1AMKNK1USP2SMN1; SMN2
Lithium Ion SCHEMBL1504295 0.81 ADORA1 (0.39) ADORA1GRAMD1AMKNK1USP2SMN1; SMN2
SCHEMBL15282792 0.80 GRAMD1A (0.44) ADORA1GRAMD1AMKNK1USP2SMN1; SMN2
SCHEMBL31569367 0.78 SCN4A (0.36) ADORA1GRAMD1AMKNK1STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260028365-A1 TYROSINE KINASE 2 INHIBITORS AND USES THEREOF BIOGEN MA INC (US) 2026-01-29 US disclosed
US-20250388604-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2025-12-25 US disclosed
US-12466822-B2 Heterocyclic compounds as immunomodulators INCYTE CORPORATION (US) 2025-11-11 US disclosed
US-20250325660-A1 IMMUNOMODULATOR COMPOUNDS AND METHODS OF USE INCYTE CORP (US) 2025-10-23 US disclosed
EP-4572762-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP disclosed
EP-4554938-A1 TYROSINE KINASE 2 INHIBITORS AND USES THEREOF Biogen MA Inc. (US) 2025-05-21 EP disclosed
CN-110582493-B Benzoxazole derivatives as immunomodulators 因赛特公司 2024-03-08 CN disclosed
WO-2024038128-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 WO disclosed
WO-2024015497-A1 TYROSINE KINASE 2 INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2024-01-18 WO disclosed
US-11787793-B2 Heterocyclic compounds as immunomodulators INCYTE CORPORATION (US) 2023-10-17 US disclosed
US-7192968-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-20 US disclosed
US-7192968-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-20 US disclosed
US-7192968-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-20 US disclosed
CN-1293057-C Ethylenediamine derivatives DAIICHI SEIYAKU CO (JP) 2007-01-03 CN disclosed
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-09 US disclosed
US-20060004009-A1 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 US disclosed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP disclosed
US-20040122063-A1 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-24 US disclosed
CN-1438993-A Ethylenediamine derivatives DAIICHI SEIYAKU CO (JP) 2003-08-27 CN disclosed
EP-1270557-A1 ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-01-02 EP 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-20060004009-A1 Ethylenediamine derivatives F2, ECE1, MLLT1 ADORA1 1447/4885GRAMD1A 1049/4885MKNK1 4202/4885
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X F2, C1S, C9 ADORA1 1535/4885GRAMD1A 2645/4885MKNK1 3223/4885
US-20250325660-A1 IMMUNOMODULATOR COMPOUNDS AND METHODS OF USE CD274, PDCD1LG2, PDCD1 ADORA1 314/4885GRAMD1A 4723/4885MKNK1 1983/4885
US-12466822-B2 Heterocyclic compounds as immunomodulators CD74, IL2, ICOS ADORA1 1316/4885GRAMD1A 4670/4885MKNK1 3660/4885
US-11787793-B2 Heterocyclic compounds as immunomodulators CD74, IL2, ICOS ADORA1 1316/4885GRAMD1A 4670/4885MKNK1 3660/4885
US-20250388604-A1 Compounds and Their Use as PDE4 Activators PDE4A, PDE7A, PDE4B ADORA1 113/4885GRAMD1A 4161/4885MKNK1 4300/4885
US-20260028365-A1 TYROSINE KINASE 2 INHIBITORS AND USES THEREOF TYK2, ERBB2, ROS1 ADORA1 2516/4885GRAMD1A 4570/4885MKNK1 599/4885
US-20040122063-A1 Ethylenediamine derivatives ECE1, F2, ECE2 ADORA1 1150/4885GRAMD1A 1143/4885MKNK1 4065/4885

“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.