SCHEMBL2830370

SCHEMBL2830370

Bc1c(C(C)C)cc(C(C)C)cc1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.50
GABRB2 P47870 2/20 0.50
FABP4 P15090 3/20 0.48
FABP3 P05413 2/20 0.48
FABP5 Q01469 1/20 0.46
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ALDH1A1 P00352 1/20 0.33
GABRB1 P18505 3/20 0.32
LMNA P02545 2/20 0.31
GAA P10253 1/20 0.30
ROCK2 O75116 1/20 0.30
TRPA1 O75762 2/20 0.30
PTGS1 P23219 1/20 0.30
CACNA1C Q13936 1/20 0.30
CHRM1 P11229 1/20 0.30
SLC6A2 P23975 1/20 0.30
ADRA1A P35348 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL18672480 0.78 CA1 (0.35) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL9064395 0.74 GABRA1 (0.52) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL3079552 0.74 GABRA1 (0.52) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL9369688 0.74 FABP4 (0.56) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL24413824 0.74 GABRA1 (0.46) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL19196630 0.74 GABRA1 (0.32) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL19359598 0.73 CA1 (0.39) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL25532287 0.73 GABRA1 (0.37) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL878114 0.72 GABRA1 (0.50) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL20816450 0.72 GABRA1 (0.50) GABRA1GABRB2FABP4FABP3FABP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143128-A Organic compound based on phenol oxygen-boron nitrogen structure and application thereof 浙江虹舞科技有限公司 2023-12-01 CN claimed
CN-117003783-A Organic compound and application thereof 清华大学 2023-11-07 CN claimed
CN-116589490-A Organic compound, application thereof and organic electroluminescent device comprising same 清华大学 2023-08-15 CN claimed
CN-116478191-A Luminescent material, application thereof and organic electroluminescent device comprising luminescent material 清华大学 2023-07-25 CN claimed
CN-116354994-A Organic compound and application thereof 清华大学 2023-06-30 CN claimed
CN-116332977-A Organic compound, application thereof and organic electroluminescent device comprising same 清华大学 2023-06-27 CN claimed
CN-103864829-B Water solublity triarylboron and its preparation method and application 中国科学院化学研究所 2016-11-23 CN claimed
CN-103864829-A Water-soluble triarylboron compound as well as preparation method and applications thereof CHINESE ACAD INST CHEMISTRY 2014-06-18 CN claimed
EP-3253583-B1 THERMAL MANAGEMENT MATERIALS CONTAINING PHASE CHANGE MATERIALS LATENT HEAT SOLUTIONS LLC (US) 2023-11-29 EP disclosed
CN-117003783-A Organic compound and application thereof 清华大学 2023-11-07 CN disclosed
CN-116589490-A Organic compound, application thereof and organic electroluminescent device comprising same 清华大学 2023-08-15 CN disclosed
CN-116354994-A Organic compound and application thereof 清华大学 2023-06-30 CN disclosed
CN-116332977-A Organic compound, application thereof and organic electroluminescent device comprising same 清华大学 2023-06-27 CN disclosed
EP-3254331-B1 SYSTEMS, STRUCTURES AND MATERIALS FOR ELECTROCHEMICAL DEVICE THERMAL MANAGEMENT LATENT HEAT SOLUTIONS LLC (US) 2023-05-10 EP disclosed
US-8097348-B2 Pi-conjugated organoboron polymers in thin-film organic electronic devices TDA RESEARCH, INC. (US) 2012-01-17 US disclosed
US-20110319554-A1 EXFOLIATION OF GRAPHITE USING IONIC LIQUIDS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2011-12-29 US disclosed
WO-2010065346-A1 EXFOLIATION OF GRAPHITE USING IONIC LIQUIDS THE UNIVERSITY OF ALABAMA (US) 2010-06-10 WO disclosed
US-20090127547-A1 PI-CONJUGATED ORGANOBORON POLYMERS IN THIN-FILM ORGANIC ELECTRONIC DEVICES TDA RESEARCH, INC. 2009-05-21 US disclosed
US-20090127547-A1 PI-CONJUGATED ORGANOBORON POLYMERS IN THIN-FILM ORGANIC ELECTRONIC DEVICES TDA RESEARCH, INC. 2009-05-21 US disclosed
WO-2007109629-A2 PI-CONJUGATED ORGANOBORON POLYMERS IN THIN-FILM ORGANIC ELECTRONIC DEVICES TDA RESEARCH, INC. (US) 2007-09-27 WO disclosed