SCHEMBL503292

SCHEMBL503292

C[Si](C)(C)C#Cc1ccc(N)nc1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 18/20 0.44
▸ PIK3CA P42336 15/20 0.44
▸ NOS3 P29474 1/20 0.43
▸ NOS2 P35228 1/20 0.43
▸ ADK P55263 1/20 0.41

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
SCHEMBL29571687 1.00 MTOR (0.44) MTORPIK3CANOS3NOS2ADK
SCHEMBL1306099 0.79 GRM5 (0.40) —
SCHEMBL10162703 0.79 NOS3 (0.46) MTORPIK3CANOS3NOS2ADK
SCHEMBL503751 0.78 CYP1A2 (0.55) MTORPIK3CA
SCHEMBL1914210 0.78 GRM5 (0.39) —
SCHEMBL27847429 0.78 GRM5 (0.39) —
SCHEMBL30583888 0.78 CYP1A2 (0.55) MTORPIK3CA
SCHEMBL19775310 0.77 MTOR (0.44) MTORPIK3CANOS3NOS2ADK
SCHEMBL1349094 0.77 HSP90AA1 (0.35) —
SCHEMBL15448027 0.76 GRM5 (0.50) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119390722-A Organic small molecular compound capable of distinguishing and detecting hydrazine and hypochlorite and preparation method thereof 华南理工大学 2025-02-07 — — CN disclosed
US-20240360104-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATED DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA FARBER CANCER INST INC (US) 2024-10-31 — — US disclosed
CN-118436643-A Therapeutic strategy of ZAK inhibitor in targeted tumor and application thereof 中国科学院上海营养与健康研究所 2024-08-06 — — CN disclosed
CN-118005630-A ZAK inhibitor, preparation method and application thereof 中国科学院上海营养与健康研究所 2024-05-10 — — CN disclosed
EP-4330253-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATED DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2024-03-06 — — EP disclosed
US-11667628-B2 Compounds for imaging tau proteins that accumulate in brain NATIONAL INSTITUTES FOR QUANTUM AND RADIOLOGICAL SCIENCE AND TECHNOLOGY (JP) 2023-06-06 — — US disclosed
US-11667628-B2 Compounds for imaging tau proteins that accumulate in brain NATIONAL INSTITUTES FOR QUANTUM AND RADIOLOGICAL SCIENCE AND TECHNOLOGY (JP) 2023-06-06 — — US disclosed
WO-2022232088-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATED DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-11-03 — — WO disclosed
EP-3481819-B1 COMPOUNDS AND THEIR USE FOR REDUCING URIC ACID LEVELS ACQUIST LLC (US) 2022-06-01 — — EP disclosed
US-20220024900-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2022-01-27 — — US disclosed
US-6894177-B2 Intermediate compounds of non-nucleoside reverse transcriptase inhibitors MEDIVIR AB (SE) 2005-05-17 — — US disclosed
EP-1423368-A1 UREA AND THIOUREA DERIVATIVES AS NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2004-06-02 — — EP disclosed
US-6716850-B2 ESPECIALLY N-(NITROGEN HETEROAR-2-YL)-SUBSTITUTED TETRAHYDROCYCLOPROPA(C)CHROMEN-1-UREAS AND THIOUREAS; TREATING HIV-1, PARTICULARLY A DRUG ESCAPE MUTANT. MEDIVIR AB (SE) 2004-04-06 — — US disclosed
EP-1373261-A2 CYCLOPROPAHETEROCYCLES AS NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2004-01-02 — — EP disclosed
US-20030187266-A1 Non-nucleoside reverse transcriptase inhibitors MEDIVIR AB (SE) 2003-10-02 — — US disclosed
US-6610714-B2 HIV viricides MEDIVIR AB (SE) 2003-08-26 — — US disclosed
US-20030092743-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2003-05-15 — — US disclosed
US-20030069224-A1 Non-nucleoside reverse transcriptase inhibitors MEDIVIR AB (SE) 2003-04-10 — — US disclosed
WO-2003020705-A1 UREA AND THIOUREA DERIVATIVES AS NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2003-03-13 — — WO disclosed
WO-2002070516-A2 CYCLOPROPAHETEROCYCLES AS NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2002-09-12 — — 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-20220024900-A1 Compounds and Their Use for Reducing Uric Acid Levels XDH, OAT, PON1 MTOR 4367/4885PIK3CA 4552/4885NOS3 989/4885
US-20030069224-A1 Non-nucleoside reverse transcriptase inhibitors SUB1, NAT10, NSUN2 MTOR 4388/4885PIK3CA 3979/4885NOS3 1484/4885
US-20240360104-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATED DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD4, TEAD1, TEAD2 MTOR 2038/4885PIK3CA 2007/4885NOS3 3715/4885
US-11667628-B2 Compounds for imaging tau proteins that accumulate in brain MAPT, FABP7, HTT MTOR 2739/4885PIK3CA 4064/4885NOS3 3318/4885
US-20030187266-A1 Non-nucleoside reverse transcriptase inhibitors SUB1, NAT10, NSUN2 MTOR 4388/4885PIK3CA 3979/4885NOS3 1484/4885
US-20030092743-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS SUB1, HCFC1, CCR1 MTOR 4406/4885PIK3CA 3191/4885NOS3 1537/4885

“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.

Send feedback