SCHEMBL783223

SCHEMBL783223

O[C@@H]1c2ccccc2C[C@@H]1O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.42
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
KDM1A O60341 4/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
HTR1A P08908 3/20 0.39
OPRM1 P35372 2/20 0.39

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
SCHEMBL29833737 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL19420453 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4168243 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8049751 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3867845 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL562559 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5271544 1.00 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5166344 0.94 ANPEP (0.39) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6550318 0.83 KDM1A (0.48) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8077009 0.81 ACHE (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030022335-A1 Novel polypeptides and methods for their use UNIVERSITY OF IOWA RESEARCH FOUNDATION 2003-01-30 US claimed
US-6171832-B1 FERMENTING STARTING MATERIAL IN CULTURE, RECOVERING PRODUCT; BY PRODUCT INHIBITION; CHEMICAL INTERMEDIATE FOR SYNTHESIS OF INDINAVIR, A POTENT HUMAN IMMUNODEFICIENCY VIRUS PROTEASE INHIBITOR MERCK & CO., INC. 2001-01-09 US claimed
US-6165777-A Process for the resolution of cis 1,2-indane diols using Pseudomonas putida ZENECA LIMITED (GB) 2000-12-26 US claimed
WO-2000037480-A1 NOVEL NAPHTHALENE DIOXYGENASE AND METHODS FOR THEIR USE UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2000-06-29 WO claimed
EP-0784697-B1 BACTERIAL PROCESS FOR THE RESOLUTION OF RACEMIC CIS-DIOLS AVECIA LTD (GB) 2000-05-03 EP claimed
EP-0874059-A2 PROCESSES FOR PRODUCING INDANE DERIVATIVES NIPPON STEEL CHEMICAL CO., LTD. (JP) 1998-10-28 EP claimed
EP-0874059-A1 PROCESSES FOR PRODUCING INDANE DERIVATIVES NIPPON STEEL CHEMICAL CO., LTD. (JP) 1998-10-28 EP claimed
US-5811294-A Production of optically active 1,2-dihydroxyindance derivatives by asymetric assimilation ZENECA LIMITED (GB) 1998-09-22 US claimed
EP-0784697-A1 BACTERIAL PROCESS FOR THE RESOLUTION OF RACEMIC CIS-DIOLS ZENECA LIMITED (GB) 1997-07-23 EP claimed
WO-1996011282-A1 BACTERIAL PROCESS FOR THE RESOLUTION OF RACEMIC CIS-DIOLS ZENECA LIMITED (GB) 1996-04-18 WO claimed
EP-0658537-A1 Method of producing cis-1-aminoindan-2-ol ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 1995-06-21 EP claimed
JP-11075888-A None JP disclosed
US-10906033-B2 Synthesis and application of chiral substituted polyvinylpyrrolidinones KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2021-02-02 US disclosed
US-10906033-B2 Synthesis and application of chiral substituted polyvinylpyrrolidinones KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2021-02-02 US disclosed
US-20200306737-A1 SYNTHESIS AND APPLICATION OF CHIRAL SUBSTITUTED POLYVINYLPYRROLIDINONES KANSAS STATE UNIVERSITY RESEARCH FOUNDATION 2020-10-01 US disclosed
US-5508404-A 3-PYRIDINE CARBOXALDEHYDE AS REACTANT IN PRESENCE OF EXCESS REDUCING AGENT YIELDING HIV PROTEASE INHIBITOR MERCK & CO., INC. (US) 1996-04-16 US disclosed
US-5489710-A AMINATION BY MIXING WITH NITRILE SOLVENT, ACIDIFICATION AND HYDROLYZING WITH WATER MERCK & CO., INC. (US) 1996-02-06 US disclosed
WO-1995024374-A1 REGIOSPECIFIC PROCESSES TO MAKE CIS-1-AMINO-2-ALKANOL FROM DIOL OR HALOHYDRIN MERCK & CO., INC. (US) 1995-09-14 WO disclosed
US-5449830-A Enzyme inhibitors for protease encoded for HIV MARCK & CO., INC. (US) 1995-09-12 US disclosed
EP-0658537-A1 Method of producing cis-1-aminoindan-2-ol ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 1995-06-21 EP 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 (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-20200306737-A1 SYNTHESIS AND APPLICATION OF CHIRAL SUBSTITUTED POLYVINYLPYRROLIDINONES POLRMT, CNBP, DHPS ANPEP 1526/4885GRIN2D 4610/4885GRIN3B 4689/4885
US-10906033-B2 Synthesis and application of chiral substituted polyvinylpyrrolidinones POLRMT, CNBP, DHPS ANPEP 1526/4885GRIN2D 4610/4885GRIN3B 4689/4885

“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.