Sugi Predict

Sugi Predict / Compounds / SCHEMBL1044055

SCHEMBL1044055

SCHEMBL1044055

OB(O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 2/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HDAC3 O15379 1/20 0.40
▸ HDAC4 P56524 1/20 0.40
▸ HDAC7 Q8WUI4 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ HDAC9 Q9UKV0 1/20 0.40
▸ HDAC5 Q9UQL6 1/20 0.40
▸ NCOR2 Q9Y618 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ ACHE P22303 2/20 0.38
▸ BCHE P06276 1/20 0.38
▸ KMT2A Q03164 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33

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
SCHEMBL29953549 1.00 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL16632987 0.84 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL5034116 0.78 GPR3 (0.34) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL9020786 0.78 ALDH1A1 (0.35) GPR3POLBACHEKMT2AMEN1
SCHEMBL1478687 0.78 GPR3 (0.44) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL9020869 0.75 PDCD1 (0.39) HTR2A
SCHEMBL18343745 0.75 GPR3 (0.32) GPR3POLBKMT2AMEN1CYP1A2
SCHEMBL27462668 0.74 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL6903531 0.69 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL221399 0.69 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504771-A Spiropyran derivative with color and fluorescence dual switch, photochromic material, and preparation method and application thereof 安徽省东超科技有限公司 2025-02-25 — — CN claimed
CN-118878402-A Preparation method of trifluoromethyl ketone compound based on palladium catalysis of C-N bond cleavage 大连理工大学 2024-11-01 — — CN claimed
CN-117865773-A Preparation method of difluoromethyl aromatic compound based on palladium-catalyzed decarbonylation coupling 大连理工大学 2024-04-12 — — CN claimed
CN-111689994-B Organic conjugated molecular material with dibenzofuran Aza-BODIPY as basic skeleton and preparation method and application thereof 安徽师范大学 2023-06-13 — — CN claimed
CN-111689994-A Organic conjugated molecular material with bifluorene Aza-BODIPY as basic skeleton and preparation method and application thereof 安徽师范大学 2020-09-22 — — CN claimed
CN-104267578-B A kind of sulfosalt class photo-acid agent containing fluorenes, preparation method and applications 同济大学 2017-12-05 — — CN claimed
CN-104267578-A Fluorene-containing sulfonium salt photoacid generator (PAG) and its preparation method and use UNIV TONGJI 2015-01-07 — — CN claimed
EP-1425168-A4 LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS UNIV ROCHESTER (US) 2007-01-03 — — EP claimed
EP-1425168-A2 LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS University of Rochester (US) 2004-06-09 — — EP claimed
US-20030039838-A1 Light-emitting organic oligomer compositions UNIVERSITY OF ROCHESTER 2003-02-27 — — US claimed
WO-2003008475-A2 LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS UNIVERSITY OF ROCHESTER (US) 2003-01-30 — — WO claimed
CN-119504771-A Spiropyran derivative with color and fluorescence dual switch, photochromic material, and preparation method and application thereof 安徽省东超科技有限公司 2025-02-25 — — CN disclosed
CN-113527330-B Compound and application thereof 北京鼎材科技有限公司 2024-05-24 — — CN disclosed
CN-111689994-B Organic conjugated molecular material with dibenzofuran Aza-BODIPY as basic skeleton and preparation method and application thereof 安徽师范大学 2023-06-13 — — CN disclosed
CN-113527330-A Compound and application thereof 北京鼎材科技有限公司 2021-10-22 — — CN disclosed
EP-1346971-A1 Production method for biarylalanine SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-09-24 — — EP disclosed
US-20030162950-A1 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2003-08-28 — — US disclosed
EP-1306131-A2 Cross-Coupling catalyst comprising a cyclic nitrogen ligand and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-05-02 — — EP disclosed
US-20030039838-A1 Light-emitting organic oligomer compositions UNIVERSITY OF ROCHESTER 2003-02-27 — — US disclosed
WO-2003008475-A2 LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS UNIVERSITY OF ROCHESTER (US) 2003-01-30 — — 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 (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-20030162950-A1 Coupling catalyst and process using the same NOD1, PYM1, C9 GPR3 1974/4885HTR2A 2225/4885HDAC3 3024/4885

“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.