SCHEMBL827478

SCHEMBL827478

CN(C)C(=O)c1ccsc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 2/20 0.61
LCK P06239 1/20 0.61
DAO P14920 1/20 0.61
CES2 O00748 1/20 0.58
CES1 P23141 1/20 0.58
HDAC1 Q13547 1/20 0.50
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CHEK2 O96017 1/20 0.44
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PDK1 Q15118 2/20 0.41
HSD11B1 P28845 1/20 0.39
C5AR1 P21730 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KCNK3 O14649 1/20 0.38
KCNK9 Q9NPC2 1/20 0.38
CHRNB2 P17787 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
SCHEMBL12786079 0.85 LCK (0.59) FYNLCKDAOCES2CES1
SCHEMBL1043936 0.80 LCK (0.53) FYNLCKDAOCES2CES1
SCHEMBL13558621 0.80 LCK (0.53) FYNLCKDAOCES2CES1
SCHEMBL11454312 0.80 LCK (0.53) FYNLCKDAOCES2CES1
SCHEMBL30284249 0.80 LCK (0.53) FYNLCKDAOCES2CES1
SCHEMBL11474426 0.80 FYN (0.53) FYNLCKDAOCES2CES1
SCHEMBL2011772 0.78 LCK (0.55) FYNLCKDAOCES2CES1
SCHEMBL28933120 0.78 LCK (0.55) FYNLCKDAOCES2CES1
SCHEMBL152166 0.77
SCHEMBL31547841 0.76 CES2 (0.50) FYNLCKDAOCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN claimed
CN-115427409-A Pyrimidin-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2022-12-02 CN claimed
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US claimed
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN disclosed
CN-115776890-A TRPV4 inhibitors as therapeutic agents for eye diseases 拉夸里亚创药株式会社 2023-03-10 CN disclosed
CN-115427409-A Pyrimidin-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2022-12-02 CN disclosed
CN-114736355-A Electron transport layer material for perovskite solar cell and preparation method and application thereof 华能新能源股份有限公司 2022-07-12 CN disclosed
CN-112500324-B Method for preparing thioamide compound 浙江大学衢州研究院 2022-05-13 CN disclosed
CN-112574081-B Process for preparing arylthioamide compounds 浙江大学衢州研究院 2022-05-10 CN disclosed
US-11139436-B2 Organic compound, and light-emitting diode and light-emitting device including the same LG DISPLAY CO., LTD. (KR) 2021-10-05 US disclosed
EP-3243818-B1 POLYMERS OF BENZODITHIOPHENE AND THEIR USE AS ORGANIC SEMICONDUCTORS RAYNERGY TEK INC (TW) 2021-02-17 EP disclosed
US-5082951-A Process for preparing 5-aroyl-2,3-dihydro-1H-pyrrolizine-1,1-dicarboxylates (I) and intermediates therefor SYNTEX (U.S.A.) INC. (US) 1992-01-21 US disclosed
US-4458081-A ANTIINFLAMMATORY, ANALGESIC, ANTICOAGULANT, MUSCLE RELAXANT SYNTEX (U.S.A.) INC. (US) 1984-07-03 US disclosed
US-4454326-A 5-Aroyl 6-chloro or 6-bromo 1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1,1-di-carboxylates SYNTEX (U.S.A.) INC. (US) 1984-06-12 US disclosed
US-4419354-A IMMUNOLOGY, ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY (US) 1983-12-06 US disclosed
US-4410534-A 3-Substituted-5,6,7,8-tetrahydropyrrolo[1,2-a]-pyridine-and 6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]-azepine carboxylic acid derivatives useful as blood platelet aggregation inhibitors SYNTEX (U.S.A.) INC. (US) 1983-10-18 US disclosed
US-4347187-A Process for preparing 5-aroyl 1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1-carboxylic acids and novel intermediates therein SYNTEX (U.S.A.) INC. (US) 1982-08-31 US disclosed
US-4347186-A Process for preparing 5-aroyl 1,2-dihydro-3-H pyrrolo[1,2-a]pyrrole-1-carboxylic acids and novel intermediates therein SYNTEX (U.S.A.) INC. (US) 1982-08-31 US disclosed
US-4344943-A ANALGESICS, ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1982-08-17 US disclosed
US-4087539-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, SMOOTH MUSCLE RELAXANTS SYNTEX (U.S.A.) INC. (US) 1978-05-02 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 (1 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-11139436-B2 Organic compound, and light-emitting diode and light-emitting device including the same DRD1, DRD2, ALDH1A2 FYN 3062/4885LCK 3060/4885DAO 422/4885

“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.