Sugi Predict

Sugi Predict / Compounds / SCHEMBL741364

SCHEMBL741364

SCHEMBL741364

O[C@@H]1CCN(Cc2ccccc2)C1

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.81
▸ NPC1 O15118 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ FUCA1 P04066 2/20 0.58
▸ ACHE P22303 2/20 0.58
▸ LTA4H P09960 5/20 0.57
▸ BCHE P06276 1/20 0.57
▸ BACE1 P56817 1/20 0.57
▸ CCR3 P51677 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ SIGMAR1 Q99720 2/20 0.55
▸ SLC18A3 Q16572 1/20 0.55
▸ GRIN1 Q05586 1/20 0.54
▸ GRIN2B Q13224 1/20 0.54

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
SCHEMBL608225 1.00 ALDH1A1 (0.81) ALDH1A1NPC1RAB9AFUCA1ACHE
SCHEMBL72716 1.00 ALDH1A1 (0.81) ALDH1A1NPC1RAB9AFUCA1ACHE
Water SCHEMBL2362659 0.98 ALDH1A1 (0.78) ALDH1A1NPC1RAB9AFUCA1ACHE
Pyridine SCHEMBL27293199 0.91 ALDH1A1 (0.68) ALDH1A1NPC1RAB9AFUCA1ACHE
SCHEMBL1787570 0.89 ALDH1A1 (1.00) ALDH1A1FUCA1LTA4HCYP1A2CYP3A4
SCHEMBL5205368 0.89 ALDH1A1 (1.00) ALDH1A1FUCA1LTA4HCYP1A2CYP3A4
SCHEMBL1552926 0.89 ALDH1A1 (1.00) ALDH1A1FUCA1LTA4HCYP1A2CYP3A4
SCHEMBL5743125 0.89 ALDH1A1 (0.66) ALDH1A1NPC1RAB9AACHELTA4H
SCHEMBL5744592 0.89 ALDH1A1 (0.66) ALDH1A1NPC1RAB9AACHELTA4H
SCHEMBL18667248 0.89 ALDH1A1 (0.74) ALDH1A1NPC1RAB9AFUCA1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111718250-B Method for preparing R-citronellal 万华化学集团股份有限公司 2022-04-22 — — CN claimed
CN-113493628-A Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2021-10-12 — — CN claimed
CN-111718250-A Method for preparing R-citronellal 万华化学集团股份有限公司 2020-09-29 — — CN claimed
CN-106281999-B A kind of community's life's Harmless treatment equipment for garbage and its method of work 江苏建筑职业技术学院 2018-06-15 — — CN claimed
CN-105854775-B A kind of manganese slag lightweight ceramic tile additive special production apparatus and method of work and its preparation method of critical component 徐州工程学院 2017-08-25 — — CN claimed
CN-106281999-A A kind of community's life's Harmless treatment equipment for garbage and method of work thereof 江苏建筑职业技术学院 2017-01-04 — — CN claimed
CN-105854775-A Production device special for manganese slag light tile additive, working method and manufacturing method of key parts of production device 徐州工程学院 2016-08-17 — — CN claimed
EP-2361244-B1 A PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE N-BENZYL-3 HYDROXYPYRROLIDINES COUNCIL SCIENT IND RES (IN) 2013-07-10 — — EP claimed
US-8445700-B2 Process for the preparation of optically active N-benzyl-3 hydroxypyrrolidines COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-05-21 — — US claimed
EP-1553170-B1 NOVEL CARBONYL REDUCTASE, GENE THEREOF AND METHOD OF USING THE SAME KANEKA CORP (JP) 2012-06-27 — — EP claimed
EP-2361244-A1 A PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE N-BENZYL-3 HYDROXYPYRROLIDINES Council of Scientific & Industrial Research (IN) 2011-08-31 — — EP claimed
WO-2010058429-A1 A PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE N-BENZYL-3 HYDROXYPYRROLIDINES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-05-27 — — WO claimed
CN-101468962-A Method for preparing (S)-2,2-phenyl-2-(3-pyrrolidinyl) acetamide UNIV BEIJING CHEMICAL (CN) 2009-07-01 — — CN claimed
US-7531329-B2 Carbonyl reductase, gene thereof and method of using the same KANEKA CORPORATION (JP) 2009-05-12 — — US claimed
US-20070178565-A1 Novel carbonyl reductase, gene thereof and method of using the same KANEKA CORPORATION 2007-08-02 — — US claimed
US-7220564-B2 Carbonyl reductase, gene thereof and method of using the same KANEKA CORPORATION (JP) 2007-05-22 — — US claimed
US-20060035357-A1 Novel carbonyl reductase, gene thereof and method of using the same KANEKA CORPORATION (JP) 2006-02-16 — — US claimed
EP-1553170-A1 NOVEL CARBONYL REDUCTASE, GENE THEREOF AND METHOD OF USING THE SAME KANEKA CORPORATION (JP) 2005-07-13 — — EP claimed
US-5187094-A Using Pseudomonas or Mucor stereospecific esterases for hydrolysis of racemic mixtures of N-benzyl-3-acyloxy-pyrrolidine KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1993-02-16 — — US claimed
EP-0391169-A2 Enantiomeric pure 7-(3-amino-1-pyrrolidinyl)-chinolon-and-naphthyridon carboxylic acids BAYER AG (DE) 1990-10-10 — — EP 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 (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-20070178565-A1 Novel carbonyl reductase, gene thereof and method of using the same PYCR1, CBR3, CBR1 ALDH1A1 478/4885NPC1 3285/4885RAB9A 4233/4885

“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.