Sugi Predict

Sugi Predict / Compounds / SCHEMBL990765

SCHEMBL990765

SCHEMBL990765

Clc1ccc(C#CBr)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.44
▸ CYP2A6 P11509 1/20 0.44
▸ KCNH2 Q12809 4/20 0.43
▸ GRM5 P41594 1/20 0.39
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 2/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ IDO1 P14902 1/20 0.35
▸ ACACB O00763 1/20 0.33
▸ HAO1 Q9UJM8 1/20 0.33
▸ APP P05067 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ ADK P55263 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ NLRP3 Q96P20 1/20 0.32

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
SCHEMBL2533168 0.85 APP (0.42) APPMAPT
SCHEMBL28693933 0.83 SRD5A2 (0.53) TSHRHTT
SCHEMBL719360 0.82 LMNA (0.57) LMNACYP2A6KCNH2GRM5MAOA
SCHEMBL20015814 0.82 LMNA (0.57) LMNACYP2A6KCNH2GRM5MAOA
Charcoal, Activated SCHEMBL31286310 0.79 KCNH2 (0.54) LMNACYP2A6KCNH2GRM5MAOA
SCHEMBL3433279 0.78 LMNA (0.44) LMNACYP2A6KCNH2GRM5MAOA
SCHEMBL30486018 0.77 CYP1A1 (0.44) KCNH2GRM5APPMAPT
SCHEMBL4461464 0.76 KCNH2 (0.47) LMNACYP2A6KCNH2GRM5MAOA
SCHEMBL20138872 0.74 CYP2A6 (0.47) LMNACYP2A6MAOAMAOBACACB
SCHEMBL2879214 0.74 LMNA (0.47) LMNACYP2A6KCNH2GRM5MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116162046-A Alkynyl sulfone derivative and preparation method and application thereof 云南民族大学 2023-05-26 — — CN claimed
CN-107986969-B Dodecahydron as benzodiindenophenanthrene derivative and synthesis method thereof 安徽师范大学 2020-06-19 — — CN claimed
CN-116162046-B Alkynyl sulfone derivative and preparation method and application thereof 云南民族大学 2025-06-13 — — CN disclosed
CN-120118016-A 1, 1-Di (indolyl) olefin compound and preparation method and application thereof 华南理工大学 2025-06-10 — — CN disclosed
CN-118515668-A Condensed ring indolizine compound and synthetic method and application thereof 安徽师范大学 2024-08-20 — — CN disclosed
CN-115819301-B Method for preparing alkynyl sulfur (selenium) ether by coupling zinc-promoted disulfide (selenium) ether with alkynyl bromine 湖南大学 2024-03-29 — — CN disclosed
CN-115197046-B Halogenation method of unsaturated hydrocarbon 华南理工大学 2023-12-15 — — CN disclosed
CN-113800998-B Preparation method of (2-bromoethynyl) benzene compound 浙江师范大学 2023-08-25 — — CN disclosed
CN-114591198-B Preparation method of cyanoalkyne compound 江苏科技大学 2023-07-21 — — CN disclosed
CN-114989063-B Synthesis method of beta-halogenated pyrrole compound 华南理工大学 2023-07-18 — — CN disclosed
CN-116162046-A Alkynyl sulfone derivative and preparation method and application thereof 云南民族大学 2023-05-26 — — CN disclosed
US-20100216814-A1 PYRIDO[4,3-B]INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. 2010-08-26 — — US disclosed
US-20100152163-A1 AZEPINO[4,5-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2010-06-17 — — US disclosed
WO-2010051501-A1 PYRIDO (4,3-B) INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. (US) 2010-05-06 — — WO disclosed
WO-2010051503-A1 AZEPINO [4, 5-B] INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2010-05-06 — — WO disclosed
WO-2010051501-A1 PYRIDO (4,3-B) INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. (US) 2010-05-06 — — WO disclosed
US-20100099667-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2010-04-22 — — US disclosed
US-20090270412-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2009-10-29 — — US disclosed
WO-2009120717-A2 PYRIDO [3, 4-B] INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2009-10-01 — — WO disclosed
WO-2009120720-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES,INC. (US) 2009-10-01 — — 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 (4 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-20090270412-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C LMNA 4568/4885CYP2A6 949/4885KCNH2 1610/4885
US-20100216814-A1 PYRIDO[4,3-B]INDOLES CONTAINING RIGID MOIETIES HTR3B, HTR3D, HTR3A LMNA 3212/4885CYP2A6 648/4885KCNH2 988/4885
US-20100152163-A1 AZEPINO[4,5-B]INDOLES AND METHODS OF USE HTR2C, HTR5A, HTR4 LMNA 4792/4885CYP2A6 469/4885KCNH2 579/4885
US-20100099667-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE HRH4, HNMT, HTR2C LMNA 4766/4885CYP2A6 1518/4885KCNH2 1184/4885

“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.