SCHEMBL5465232

SCHEMBL5465232

[CH]1C2CCCCC2CC2CCCCC12

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL551724 0.97 ALDH1A1 (0.39) ALDH1A1
SCHEMBL18145177 0.97 ALDH1A1 (0.39) ALDH1A1
SCHEMBL1408600 0.94 ALDH1A1 (0.33) ALDH1A1
SCHEMBL26122620 0.87 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1065644 0.75
SCHEMBL25393445 0.73
SCHEMBL210674 0.71 ALDH1A1 (0.64) ALDH1A1
SCHEMBL8070566 0.71 ALDH1A1 (0.64) ALDH1A1
SCHEMBL8797 0.71
SCHEMBL23926891 0.71

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070089604-A1 Novel chromatographic stationary phase AGILENT TECHNOLOGIES, INC. 2007-04-26 US claimed
US-20070090052-A1 Chromatographic stationary phase AGILENT TECHNOLOGIES, INC. 2007-04-26 US claimed
CN-111343966-B Composition comprising baicalin and specific acrylic polymer 莱雅公司 2023-10-20 CN disclosed
CN-116898752-A Composition comprising baicalin and specific acrylic polymer 莱雅公司 2023-10-20 CN disclosed
CN-105541659-A Halogenated oxime derivatives and their use as potential acid CIBA SPECIALTY CHEMICALS HOLDING INC 2016-05-04 CN disclosed
CN-105473666-A Novel compound and composition containing novel compound ADEKA CORP 2016-04-06 CN disclosed
CN-103370304-A Sulfonium sulfates, their preparation and use BASF SE 2013-10-23 CN disclosed
CN-101595109-B 7, 8-dihydro-1, 6-naphthyridin-5 (6H) -ones and related bicyclic compounds as dipeptidyl peptidase IV inhibitors and methods BRISTOL MYERS SQUIBB CO 2012-09-05 CN disclosed
CN-101595109-A 7, 8-dihydro-1, 6-naphthyridin-5 (6H) -ones and related bicyclic compounds as dipeptidyl peptidase IV inhibitors and methods BRISTOL MYERS SQUIBB CO (US) 2009-12-02 CN disclosed
CN-100513514-C Organic polymer light-emitting element material having gold complex structure and organic polymer light-emitting element SHOWA DENKO KK (JP) 2009-07-15 CN disclosed
US-20070089604-A1 Novel chromatographic stationary phase AGILENT TECHNOLOGIES, INC. 2007-04-26 US disclosed
US-20070090052-A1 Chromatographic stationary phase AGILENT TECHNOLOGIES, INC. 2007-04-26 US disclosed
US-20070084774-A1 Chromatographic stationary phase AGILENT TECHNOLOGIES, INC. 2007-04-19 US disclosed
CN-1902178-A Therapeutic agents useful for treating pain EURO CELTIQUE SA (LU) 2007-01-24 CN disclosed
CN-1856489-A Phenyl-carboxamide compounds useful for treating pain EURO CELTIQUE SA (LU) 2006-11-01 CN disclosed
CN-1832935-A Therapeutic agent for treating pain EURO CELTIQUE SA (LU) 2006-09-13 CN disclosed
CN-1780898-A Organic polymer light-emitting element material having gold complex structure and organic polymer light-emitting element SHOWA DENKO KK (JP) 2006-05-31 CN disclosed