SCHEMBL741598

SCHEMBL741598

CC(C)(C)OC(=O)N1CCc2ncsc2C1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
MAPT P10636 3/20 0.48
ADORA1 P30542 2/20 0.48
KDM4E B2RXH2 1/20 0.47
GRAMD1A Q96CP6 1/20 0.46
ESR2 Q92731 1/20 0.46
NR1H2 P55055 2/20 0.45
MKNK1 Q9BUB5 3/20 0.43
GRM5 P41594 1/20 0.42
P2RX3 P56373 4/20 0.42

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
SCHEMBL30916184 1.00 MAPK1 (0.58) MAPK1MAPTADORA1KDM4EGRAMD1A
SCHEMBL6436553 0.90 MAPK1 (0.49) MAPK1MAPTADORA1KDM4EGRAMD1A
SCHEMBL25389751 0.89 ESR2 (0.46) MAPK1MAPTADORA1KDM4EGRAMD1A
SCHEMBL30740130 0.87 MAPK1 (0.45) MAPK1MAPTADORA1KDM4EGRAMD1A
SCHEMBL30513269 0.86 MAPK1 (0.63) MAPK1MAPTKDM4EGRM5
SCHEMBL741667 0.82 MAPK1 (0.59) MAPK1MAPTKDM4EGRM5
SCHEMBL30513280 0.79 MAPK1 (0.55) MAPK1MAPTKDM4EGRM5
SCHEMBL28474185 0.78 MAPK1 (0.68) MAPK1GRM5
SCHEMBL30988529 0.78 MAPK1 (0.45) MAPK1MAPTGRM5
SCHEMBL4052245 0.77 MAPK1 (0.67) MAPK1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025011617-A1 FUSED HETEROAROMATIC RING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF 杭州圣域生物医药科技有限公司 2025-01-16 WO disclosed
CN-119306741-A Fused-ring heteroaromatic ring compound, intermediate, preparation method and application 杭州圣域生物医药科技有限公司 2025-01-14 CN disclosed
CN-118946555-A Compounds having T-structures formed by at least four rings for use in the treatment of cancer and other indications 瑟拉斯有限公司 2024-11-12 CN disclosed
US-12139498-B1 Positive allosteric modulators of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2024-11-12 US disclosed
US-20240368188-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2024-11-07 US disclosed
CN-110582493-B Benzoxazole derivatives as immunomodulators 因赛特公司 2024-03-08 CN disclosed
CN-111793077-B PD-1/PD-L1 small molecule inhibitor and application thereof in medicines 东莞市东阳光新药研发有限公司 2023-08-04 CN disclosed
CN-110267953-B Tetrahydroimidazo [4,5-C ] pyridine derivatives as inducers of PD-L1 internalization 因赛特公司 2022-12-20 CN disclosed
CN-109890819-B Heterocyclic compounds as immunomodulators 因赛特公司 2022-11-22 CN disclosed
US-20170210751-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-07-27 US 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
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP disclosed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
US-20040122063-A1 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-24 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP 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 (9 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 MAPK1 1349/4885MAPT 4475/4885ADORA1 1447/4885
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 MAPK1 2214/4885MAPT 4451/4885ADORA1 1535/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R MAPK1 1864/4885MAPT 4271/4885ADORA1 1667/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R MAPK1 1864/4885MAPT 4271/4885ADORA1 1667/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R MAPK1 1864/4885MAPT 4271/4885ADORA1 1667/4885
US-20240368188-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM5, CHRM1 MAPK1 2562/4885MAPT 408/4885ADORA1 140/4885
US-12139498-B1 Positive allosteric modulators of the muscarinic acetylcholine receptor M4 CHRM4, CHRM5, CHRM1 MAPK1 2723/4885MAPT 365/4885ADORA1 143/4885
US-20170210751-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 MAPK1 936/4885MAPT 3461/4885ADORA1 2436/4885
US-20040122063-A1 Ethylenediamine derivatives ECE1, F2, ECE2 MAPK1 987/4885MAPT 4605/4885ADORA1 1150/4885

“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.