SCHEMBL23447

SCHEMBL23447

COc1cccc(N=C=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
HTR3A P46098 1/20 0.53
HTR3D Q70Z44 1/20 0.53
HTR3C Q8WXA8 1/20 0.53
TAAR1 Q96RJ0 1/20 0.51
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
GSK3B P49841 3/20 0.46
ACHE P22303 1/20 0.45
CYP3A4 P08684 3/20 0.45
CYP1A2 P05177 2/20 0.45
RECQL P46063 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
SIGMAR1 Q99720 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL29541540 1.00 HTR3E (0.53) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8943270 0.87 CYP3A4 (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8103653 0.87 TDP1 (0.65) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL29808710 0.84 TDP1 (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL5104173 0.84 TDP1 (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10810705 0.83 TAAR1 (0.47) TAAR1SIGMAR1MAPK1
SCHEMBL7133728 0.82 CYP3A4 (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8675079 0.82 ACHE (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL17707284 0.81 HTR3E (0.62) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10818541 0.81 HTR3E (0.62) HTR3EHTR3BHTR3AHTR3DHTR3C

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 1777 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119161580-A Amide group-containing polydisulfide degradable high polymer material and preparation method thereof 衢州化工新材料创新研究院 2024-12-20 CN claimed
US-20230151136-A1 CATALYST COMPOSITION FOR POLYURETHANES MOMENTIVE PERFORMANCE MATERIALS INC. 2023-05-18 US claimed
US-20230134280-A1 CATALYSTS FOR THE FORMATION OF POLYURETHANES MOMENTIVE PERFORMANCE MATERIALS INC. 2023-05-04 US claimed
EP-4114877-A1 CATALYSTS FOR THE FORMATION OF POLYURETHANES Momentive Performance Materials Inc. (US) 2023-01-11 EP claimed
EP-4114566-A1 CATALYST COMPOSITION FOR POLYURETHANES Momentive Performance Materials Inc. (US) 2023-01-11 EP claimed
CN-115243789-A Catalyst composition for polyurethane 迈图高新材料公司 2022-10-25 CN claimed
CN-115210283-A Catalysts for polyurethane formation 迈图高新材料公司 2022-10-18 CN claimed
CN-114276303-A Ureido compound or its medicinal salt and its preparing process and application 河南大学 2022-04-05 CN claimed
US-20210332211-A1 CATALYSTS FOR PRODUCING POLYURETHANES MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2021-10-28 US claimed
CN-112791511-A Oriented porous structure material for filtration and preparation method thereof 扬州大学 2021-05-14 CN claimed
US-20040215038-A1 Colorant precursor compositions XEROX CORPORATION 2004-10-28 US claimed
US-20040215002-A1 Colorant compositions XEROX CORPORATION 2004-10-28 US claimed
US-20040215022-A1 Colorant compositions XEROX CORPORATION 2004-10-28 US claimed
US-20040214918-A1 Colorant compositions XEROX CORPORATION 2004-10-28 US claimed
US-6790267-B1 METHINE COLORANT COMPOUNDS FOR PHASE CHANGE INKS XEROX CORPORATION 2004-09-14 US claimed
US-20040167249-A1 Phase change inks with isocyanate-derived antioxidants and UV stabilizers XEROX CORPORATION 2004-08-26 US claimed
US-6764541-B1 Colorant compositions XEROX CORPORATION 2004-07-20 US claimed
US-6652635-B2 Cyan phase change inks XEROX CORPORATION 2003-11-25 US claimed
US-20030079645-A1 Cyan phase change inks XEROX CORPORATION 2003-05-01 US claimed
US-5229243-A Addition polymer core, polyurethane or polythiourethane shell KAO CORPORATION (JP) 1993-07-20 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20040215022-A1 Colorant compositions ARSA, TST, IK HTR3E 3030/4885HTR3B 2965/4885HTR3A 2548/4885
US-20040215038-A1 Colorant precursor compositions RB1, SULT1A1, CBR1 HTR3E 3396/4885HTR3B 2825/4885HTR3A 2428/4885

“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.